#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3flk s PHE 6 N 0.00 3.33 -0.21 0.66 0.08 -0.31 -5.01 117.98 116.52 3flk s PHE 6 Ca 0.00 0.21 -0.15 0.00 0.12 0.00 0.00 56.93 57.10 3flk s PHE 6 Cb 0.00 -2.08 -0.04 0.00 -0.57 0.00 0.00 43.02 40.33 3flk s PHE 6 CO 0.00 0.27 0.37 1.03 -0.10 0.00 0.00 175.22 176.79 3flk s ARG 7 N 0.16 4.16 -0.17 0.44 0.52 -1.26 -0.89 118.95 121.91 3flk s ARG 7 Ca 0.06 0.13 -0.02 0.00 -0.52 0.00 0.00 55.73 55.39 3flk s ARG 7 Cb -0.12 -3.54 -0.01 0.00 0.52 0.00 0.00 34.95 31.80 3flk s ARG 7 CO -0.00 -0.03 -0.09 0.42 0.02 0.00 0.00 175.30 175.62 3flk s ILE 8 N 1.29 3.21 -0.49 1.52 -1.09 0.20 -0.83 121.20 125.01 3flk s ILE 8 Ca 0.17 -0.58 -0.23 0.00 -2.23 0.00 0.00 60.65 57.79 3flk s ILE 8 Cb -0.15 -2.40 0.04 0.00 -1.58 0.00 0.00 42.46 38.37 3flk s ILE 8 CO 0.07 0.48 0.80 0.00 -1.23 0.00 0.00 174.94 175.06 3flk s ALA 9 N 0.88 3.27 -0.26 9.38 0.00 -0.63 -1.04 121.76 133.36 3flk s ALA 9 Ca -0.02 -1.24 -0.16 0.00 0.00 0.00 0.00 51.96 50.54 3flk s ALA 9 Cb -0.15 -3.53 -0.03 0.00 0.00 0.00 0.00 23.12 19.41 3flk s ALA 9 CO 0.00 -2.09 0.42 0.00 0.00 0.00 0.00 175.76 174.10 3flk s ALA 10 N 3.36 3.57 -0.37 0.00 0.00 0.81 -0.32 121.76 128.81 3flk s ALA 10 Ca 0.27 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.52 3flk s ALA 10 Cb -0.14 -2.76 0.12 0.00 0.00 0.00 0.00 23.12 20.34 3flk s ALA 10 CO 0.19 -0.65 0.16 0.42 0.00 0.00 0.00 175.76 175.88 3flk s ILE 11 N 2.07 1.18 0.22 0.00 1.01 0.19 -1.07 121.20 124.80 3flk s ILE 11 Ca 0.17 -1.98 -0.07 0.00 0.00 0.00 0.00 60.65 58.77 3flk s ILE 11 Cb -0.16 -1.86 0.13 0.00 0.01 0.00 0.00 42.46 40.59 3flk s ILE 11 CO 0.09 -0.78 1.74 1.55 0.00 0.00 0.00 174.94 177.55 3flk h PRO 12 N 7.42 1.10 0.00 2.79 0.13 -1.82 -0.11 132.00 141.52 3flk h PRO 12 Ca -0.07 -0.25 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3flk h PRO 12 Cb 0.97 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3flk h PRO 12 CO 0.47 0.96 0.00 0.41 -0.23 0.00 0.00 178.00 179.61 3flk n GLY 13 N -0.73 0.69 3.73 1.56 0.00 -1.26 -1.97 105.19 107.21 3flk n GLY 13 Ca 0.05 -0.64 -0.23 0.00 0.00 0.00 0.00 46.02 45.21 3flk n GLY 13 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3flk s ASP 14 N -4.00 4.90 1.08 1.61 1.01 0.12 -4.70 116.67 116.69 3flk s ASP 14 Ca 0.00 -0.57 0.00 0.00 0.71 0.00 0.00 52.55 52.69 3flk s ASP 14 Cb 0.00 -0.97 0.00 0.00 1.01 0.00 0.00 42.92 42.96 3flk s ASP 14 CO 0.00 -0.12 0.00 0.61 0.21 0.00 0.00 175.17 175.87 3flk n GLY 15 N -1.08 2.95 0.04 0.21 0.00 -1.26 -1.66 105.19 104.38 3flk n GLY 15 Ca -0.05 -0.16 0.06 0.00 0.00 0.00 0.00 46.02 45.86 3flk n GLY 15 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3flk n ILE 16 N 0.00 1.29 -0.12 -0.61 -5.35 -0.24 -1.12 119.36 113.22 3flk n ILE 16 Ca 0.00 0.38 0.10 0.00 -0.27 0.00 0.00 62.75 62.96 3flk n ILE 16 Cb 0.00 -1.27 0.45 0.00 -1.74 0.00 0.00 39.64 37.08 3flk n ILE 16 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 3flk h GLY 17 N 1.39 0.73 2.00 3.28 0.00 -1.53 0.11 103.07 109.06 3flk h GLY 17 Ca 0.00 -0.22 -0.07 0.00 0.00 0.00 0.00 47.33 47.04 3flk h GLY 17 CO 0.00 0.14 -0.33 1.41 0.00 0.00 0.00 176.54 177.76 3flk h LEU 18 N 0.54 0.00 0.14 3.11 3.38 -1.25 -2.73 115.31 118.50 3flk h LEU 18 Ca 0.29 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.96 3flk h LEU 18 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3flk h LEU 18 CO -0.09 0.33 -1.52 -0.33 0.09 0.00 0.00 178.44 176.92 3flk h GLU 19 N 0.00 0.30 0.05 1.13 5.08 -1.27 -3.41 114.58 116.46 3flk h GLU 19 Ca -0.00 -0.51 -0.26 0.00 -1.00 0.00 0.00 59.36 57.59 3flk h GLU 19 Cb 0.89 0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.30 3flk h GLU 19 CO 0.04 1.24 -1.31 -0.39 -1.00 0.00 0.00 179.01 177.59 3flk h VAL 20 N -0.16 1.37 -0.22 3.13 -1.51 -0.92 -3.38 116.25 114.55 3flk h VAL 20 Ca -0.32 -3.07 0.04 0.00 -1.23 0.00 0.00 66.70 62.12 3flk h VAL 20 Cb 1.87 2.75 -0.04 0.00 -2.13 0.00 0.00 31.29 33.75 3flk h VAL 20 CO 0.10 0.83 -0.02 0.25 -1.23 0.00 0.00 177.57 177.49 3flk h LEU 21 N 0.03 -0.14 -2.11 4.19 5.85 -1.71 -1.68 115.31 119.75 3flk h LEU 21 Ca -0.14 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.67 3flk h LEU 21 Cb 1.91 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 43.04 3flk h LEU 21 CO 0.14 -0.04 0.11 -0.65 -0.34 0.00 0.00 178.44 177.65 3flk h PRO 22 N 0.04 0.00 -0.20 5.25 0.11 -1.79 -0.63 132.00 134.78 3flk h PRO 22 Ca 0.11 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 66.03 3flk h PRO 22 Cb 0.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.26 3flk h PRO 22 CO -0.20 0.00 -0.64 0.93 -0.21 0.00 0.00 178.00 177.88 3flk h GLU 23 N 0.00 0.71 -0.18 1.05 4.39 -1.52 -0.88 114.58 118.15 3flk h GLU 23 Ca 0.06 -0.50 0.00 0.00 0.34 0.00 0.00 59.36 59.27 3flk h GLU 23 Cb 0.28 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 3flk h GLU 23 CO -0.00 1.12 0.11 0.78 -1.16 0.00 0.00 179.01 179.86 3flk h GLY 24 N 0.84 0.25 1.01 -3.84 0.00 -0.48 -2.36 103.07 98.49 3flk h GLY 24 Ca -0.01 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.20 3flk h GLY 24 CO 0.13 0.10 0.41 -2.22 0.00 0.00 0.00 176.54 174.95 3flk h ILE 25 N 0.22 1.23 -0.18 2.60 2.04 -1.15 -1.34 117.51 120.93 3flk h ILE 25 Ca 0.06 -0.57 0.05 0.00 1.00 0.00 0.00 64.86 65.40 3flk h ILE 25 Cb 0.00 0.24 -0.06 0.00 -0.74 0.00 0.00 36.82 36.26 3flk h ILE 25 CO -0.01 0.25 -0.19 -0.09 0.00 0.00 0.00 178.15 178.11 3flk h ARG 26 N 1.03 -0.21 -0.39 2.37 2.43 -1.01 1.00 114.38 119.60 3flk h ARG 26 Ca 0.26 0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.33 3flk h ARG 26 Cb 0.04 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 3flk h ARG 26 CO -0.04 -0.14 -0.23 0.28 -1.51 0.00 0.00 179.97 178.33 3flk h VAL 27 N -0.21 1.27 -0.71 0.20 2.07 -1.25 -2.01 116.25 115.61 3flk h VAL 27 Ca 0.12 -1.35 -0.04 0.00 0.82 0.00 0.00 66.70 66.24 3flk h VAL 27 Cb 0.39 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 3flk h VAL 27 CO -0.31 0.45 0.28 -0.07 0.02 0.00 0.00 177.57 177.94 3flk h LEU 28 N 0.69 0.99 -0.91 2.57 3.38 -0.89 0.12 115.31 121.26 3flk h LEU 28 Ca 0.09 -0.18 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 3flk h LEU 28 Cb 0.75 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 3flk h LEU 28 CO 0.06 0.90 -0.20 -0.33 0.09 0.00 0.00 178.44 178.96 3flk h GLU 29 N 1.02 0.58 -0.49 1.13 5.08 -0.64 0.19 114.58 121.46 3flk h GLU 29 Ca 0.24 -0.21 -0.12 0.00 -1.00 0.00 0.00 59.36 58.27 3flk h GLU 29 Cb 0.22 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 3flk h GLU 29 CO -0.02 0.74 -0.17 0.00 -1.00 0.00 0.00 179.01 178.57 3flk h ALA 30 N 1.27 0.79 -0.53 3.43 0.00 -1.11 -1.84 119.26 121.26 3flk h ALA 30 Ca 0.08 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 3flk h ALA 30 Cb 0.63 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3flk h ALA 30 CO 0.04 0.66 -0.08 0.00 0.00 0.00 0.00 179.25 179.88 3flk h ALA 31 N 0.97 0.85 -0.38 0.00 0.00 -0.63 -2.33 119.26 117.74 3flk h ALA 31 Ca 0.12 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 3flk h ALA 31 Cb 0.72 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 3flk h ALA 31 CO 0.06 0.65 0.14 0.00 0.00 0.00 0.00 179.25 180.10 3flk h ALA 32 N 1.03 0.50 -0.29 0.00 0.00 -0.50 -2.12 119.26 117.87 3flk h ALA 32 Ca 0.14 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3flk h ALA 32 Cb 0.62 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3flk h ALA 32 CO 0.04 0.12 0.18 1.25 0.00 0.00 0.00 179.25 180.84 3flk h LEU 33 N 0.47 0.34 -0.76 0.00 5.85 -1.32 0.99 115.31 120.88 3flk h LEU 33 Ca 0.12 -0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 3flk h LEU 33 Cb 0.22 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 3flk h LEU 33 CO -0.01 0.28 0.27 0.50 -0.34 0.00 0.00 178.44 179.14 3flk h LYS 34 N 0.38 1.17 -0.26 1.25 3.64 -1.30 -3.22 116.57 118.23 3flk h LYS 34 Ca 0.11 -0.24 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 3flk h LYS 34 Cb -0.01 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 3flk h LYS 34 CO -0.02 0.97 0.00 0.72 -2.27 0.00 0.00 179.45 178.85 3flk n HIS 35 N -4.27 0.34 -2.47 1.91 8.25 -0.81 -4.99 115.22 113.18 3flk n HIS 35 Ca 0.06 -0.31 -0.12 0.00 -0.26 0.00 0.00 57.72 57.10 3flk n HIS 35 Cb 0.21 -0.01 0.01 0.00 1.12 0.00 0.00 29.99 31.32 3flk n HIS 35 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3flk n GLY 36 N 0.72 -0.04 3.79 -1.41 0.00 0.13 -4.91 105.19 103.47 3flk n GLY 36 Ca 0.11 -0.33 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 3flk n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3flk s LEU 37 N -3.65 4.25 -0.44 0.99 1.43 0.01 -5.02 118.68 116.25 3flk s LEU 37 Ca 0.09 1.81 -0.12 0.00 -1.03 0.00 0.00 54.13 54.89 3flk s LEU 37 Cb -0.04 -4.13 0.07 0.00 0.03 0.00 0.00 46.19 42.12 3flk s LEU 37 CO 0.11 -0.14 0.31 0.00 0.23 0.00 0.00 176.35 176.87 3flk s ALA 38 N -1.73 3.40 -0.03 4.21 0.00 -1.26 -4.67 121.76 121.68 3flk s ALA 38 Ca 0.53 -2.12 0.06 0.00 0.00 0.00 0.00 51.96 50.43 3flk s ALA 38 Cb -0.17 -2.83 -0.01 0.00 0.00 0.00 0.00 23.12 20.11 3flk s ALA 38 CO 0.22 -1.67 -0.21 -0.51 0.00 0.00 0.00 175.76 173.58 3flk s LEU 39 N 1.52 2.02 -0.11 0.00 1.43 -1.26 -1.16 118.68 121.11 3flk s LEU 39 Ca 0.03 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 3flk s LEU 39 Cb -0.23 -1.10 0.02 0.00 0.03 0.00 0.00 46.19 44.91 3flk s LEU 39 CO 0.04 0.24 -0.10 -0.70 0.23 0.00 0.00 176.35 176.05 3flk s GLU 40 N -0.36 1.78 -0.17 1.70 2.12 -0.06 -4.95 118.70 118.76 3flk s GLU 40 Ca 0.05 -0.37 -0.06 0.00 0.36 0.00 0.00 54.97 54.94 3flk s GLU 40 Cb -0.09 -1.69 -0.04 0.00 0.26 0.00 0.00 34.13 32.56 3flk s GLU 40 CO 0.00 -0.19 0.05 -0.06 -0.54 0.00 0.00 175.26 174.52 3flk s PHE 41 N 1.42 3.23 -0.09 5.30 0.08 -1.26 0.60 117.98 127.26 3flk s PHE 41 Ca 0.01 0.05 0.04 0.00 0.12 0.00 0.00 56.93 57.15 3flk s PHE 41 Cb -0.13 -2.03 -0.00 0.00 -0.57 0.00 0.00 43.02 40.28 3flk s PHE 41 CO -0.06 0.18 -0.23 -0.51 -0.10 0.00 0.00 175.22 174.50 3flk s ASP 42 N 0.20 2.95 -0.17 1.36 1.01 -0.21 -4.96 116.67 116.84 3flk s ASP 42 Ca 0.03 -0.52 -0.09 0.00 0.71 0.00 0.00 52.55 52.68 3flk s ASP 42 Cb -0.12 -1.23 -0.05 0.00 1.01 0.00 0.00 42.92 42.53 3flk s ASP 42 CO 0.01 0.17 0.12 -0.89 0.21 0.00 0.00 175.17 174.79 3flk s THR 43 N 0.26 5.35 -0.08 -1.27 2.01 -1.26 -0.14 115.64 120.52 3flk s THR 43 Ca -0.15 0.16 0.03 0.00 0.31 0.00 0.00 61.69 62.04 3flk s THR 43 Cb -0.17 -3.41 -0.02 0.00 0.01 0.00 0.00 72.50 68.92 3flk s THR 43 CO 0.07 0.50 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.99 3flk s PHE 44 N -0.06 2.71 -0.76 4.92 0.08 -0.23 -4.97 117.98 119.67 3flk s PHE 44 Ca 0.10 -0.38 0.24 0.00 0.12 0.00 0.00 56.93 57.01 3flk s PHE 44 Cb -0.11 -1.70 0.38 0.00 -0.57 0.00 0.00 43.02 41.02 3flk s PHE 44 CO -0.00 0.01 1.33 0.39 -0.10 0.00 0.00 175.22 176.85 3flk n GLU 45 N 2.78 0.19 -0.13 0.44 -0.58 -1.26 -4.33 120.64 117.76 3flk n GLU 45 Ca -0.18 0.05 -0.01 0.00 -0.42 0.00 0.00 57.16 56.61 3flk n GLU 45 Cb 0.52 -1.61 0.00 0.00 -0.57 0.00 0.00 31.44 29.79 3flk n GLU 45 CO 0.00 0.00 0.00 -2.67 -0.48 0.00 0.00 177.13 173.98 3flk n TRP 46 N -1.88 -3.90 -3.75 -0.32 4.27 -1.26 -4.41 117.44 106.18 3flk n TRP 46 Ca 0.04 -0.02 -0.24 0.00 -3.89 0.00 0.00 57.50 53.38 3flk n TRP 46 Cb 0.40 -0.02 0.04 0.00 -1.36 0.00 0.00 31.31 30.37 3flk n TRP 46 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3flk n ALA 47 N -3.01 -1.70 -2.64 -1.67 0.00 -1.26 -4.60 120.51 105.63 3flk n ALA 47 Ca -0.00 0.02 -0.09 0.00 0.00 0.00 0.00 53.44 53.36 3flk n ALA 47 Cb 0.01 -3.17 -0.08 0.00 0.00 0.00 0.00 19.45 16.21 3flk n ALA 47 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3flk s SER 48 N -3.91 0.13 0.39 0.00 1.04 -1.26 -4.37 113.70 105.71 3flk s SER 48 Ca 0.28 -0.57 0.21 0.00 0.48 0.00 0.00 55.95 56.35 3flk s SER 48 Cb -0.14 0.30 0.67 0.00 0.10 0.00 0.00 66.02 66.96 3flk s SER 48 CO 0.81 -0.64 1.72 0.00 0.98 0.00 0.00 173.24 176.11 3flk h ASP 50 N 0.00 0.94 -0.27 0.00 5.19 -1.94 -1.08 116.42 119.25 3flk h ASP 50 Ca -0.00 -0.22 -0.06 0.00 -0.62 0.00 0.00 57.03 56.12 3flk h ASP 50 Cb 0.92 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 40.16 3flk h ASP 50 CO 0.04 0.91 -0.03 0.22 -3.12 0.00 0.00 179.24 177.26 3flk h TYR 51 N 0.92 0.66 -0.50 4.55 3.20 -1.78 -2.96 116.97 121.06 3flk h TYR 51 Ca 0.20 -0.09 -0.08 0.00 3.14 0.00 0.00 58.73 61.91 3flk h TYR 51 Cb 0.32 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.39 3flk h TYR 51 CO 0.02 0.65 0.01 -0.92 -1.64 0.00 0.00 178.16 176.29 3flk h TYR 52 N 0.59 0.95 0.00 -3.82 3.20 -1.06 -1.05 116.97 115.78 3flk h TYR 52 Ca 0.12 -0.16 -0.03 0.00 3.14 0.00 0.00 58.73 61.80 3flk h TYR 52 Cb 0.42 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.44 3flk h TYR 52 CO 0.02 0.89 -0.15 -0.07 -1.64 0.00 0.00 178.16 177.21 3flk h LEU 53 N 0.74 0.00 0.12 2.82 3.38 -1.08 0.19 115.31 121.47 3flk h LEU 53 Ca 0.14 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.75 3flk h LEU 53 Cb 0.50 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 3flk h LEU 53 CO 0.02 0.15 -1.98 1.67 0.09 0.00 0.00 178.44 178.39 3flk n GLN 54 N -3.50 0.75 -0.00 1.13 7.27 -1.13 -4.65 117.38 117.25 3flk n GLN 54 Ca -0.01 0.26 0.04 0.00 0.07 0.00 0.00 57.00 57.37 3flk n GLN 54 Cb 0.30 -1.72 -0.06 0.00 2.41 0.00 0.00 30.24 31.18 3flk n GLN 54 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 3flk n HIS 55 N -3.45 0.00 -0.87 3.69 8.25 -0.41 -5.00 115.22 117.43 3flk n HIS 55 Ca -0.31 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.15 3flk n HIS 55 Cb 1.05 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 32.08 3flk n HIS 55 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3flk n GLY 56 N 1.49 0.90 0.00 -1.41 0.00 0.64 -5.03 105.19 101.77 3flk n GLY 56 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3flk n GLY 56 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3flk n LYS 57 N -2.10 0.00 -3.68 1.61 2.85 -1.25 -5.03 118.16 110.57 3flk n LYS 57 Ca 0.00 0.00 -0.27 0.00 -1.05 0.00 0.00 58.31 56.99 3flk n LYS 57 Cb 0.00 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 34.35 3flk n LYS 57 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 3flk s PRO 60 N 1.96 3.52 0.53 -1.58 0.04 -1.26 -3.45 135.00 134.75 3flk s PRO 60 Ca 0.00 -0.35 0.20 0.00 0.04 0.00 0.00 61.00 60.88 3flk s PRO 60 Cb 0.00 -2.82 1.34 0.00 0.04 0.00 0.00 34.50 33.06 3flk s PRO 60 CO 0.00 0.38 2.11 -0.44 0.04 0.00 0.00 177.00 179.09 3flk h ASP 61 N 1.86 0.00 -0.89 6.66 5.19 -2.04 -2.56 116.42 124.64 3flk h ASP 61 Ca -0.48 0.00 -0.39 0.00 -0.62 0.00 0.00 57.03 55.53 3flk h ASP 61 Cb 1.19 0.00 -0.23 0.00 0.18 0.00 0.00 39.33 40.47 3flk h ASP 61 CO 0.67 0.00 0.50 -0.90 -3.12 0.00 0.00 179.24 176.39 3flk n ASP 62 N -4.44 4.19 -0.36 6.45 5.75 -1.26 -4.65 116.55 122.23 3flk n ASP 62 Ca 0.01 -3.43 0.04 0.00 -0.01 0.00 0.00 54.79 51.39 3flk n ASP 62 Cb 0.24 -0.80 0.19 0.00 -1.03 0.00 0.00 41.12 39.72 3flk n ASP 62 CO 0.00 0.00 0.00 4.11 -0.11 0.00 0.00 177.20 181.20 3flk h TRP 63 N 1.67 1.17 -0.38 2.11 5.08 -1.90 -2.15 115.95 121.56 3flk h TRP 63 Ca 0.48 0.03 -0.15 0.00 1.08 0.00 0.00 58.89 60.34 3flk h TRP 63 Cb 2.65 -0.38 -0.01 0.00 -3.00 0.00 0.00 29.16 28.42 3flk h TRP 63 CO 1.46 0.56 -0.35 0.00 -1.28 0.00 0.00 178.44 178.83 3flk h ALA 64 N 1.48 0.66 -0.81 0.11 0.00 -1.87 -1.06 119.26 117.77 3flk h ALA 64 Ca 0.45 -0.44 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3flk h ALA 64 Cb 0.28 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 3flk h ALA 64 CO -0.21 0.67 0.53 1.49 0.00 0.00 0.00 179.25 181.73 3flk h GLU 65 N 0.72 1.02 -0.19 0.00 4.81 -1.81 -2.03 114.58 117.10 3flk h GLU 65 Ca 0.07 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.14 3flk h GLU 65 Cb 0.92 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 30.07 3flk h GLU 65 CO 0.09 0.68 -0.26 1.96 -0.73 0.00 0.00 179.01 180.74 3flk h GLN 66 N 1.05 0.51 0.00 1.92 4.20 -1.06 -3.31 115.11 118.42 3flk h GLN 66 Ca 0.31 -0.29 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 3flk h GLN 66 Cb -0.05 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.75 3flk h GLN 66 CO -0.09 0.89 -0.09 -0.07 -0.67 0.00 0.00 178.83 178.80 3flk h LEU 67 N 0.16 0.00 -1.04 1.46 3.38 -1.14 -3.08 115.31 115.06 3flk h LEU 67 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3flk h LEU 67 Cb 0.83 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.58 3flk h LEU 67 CO 0.06 0.09 0.00 0.11 0.09 0.00 0.00 178.44 178.79 3flk h LYS 68 N 0.00 0.00 -0.00 1.13 1.57 -1.45 -1.96 116.57 115.86 3flk h LYS 68 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3flk h LYS 68 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.30 3flk h LYS 68 CO 0.01 0.00 -0.00 1.04 -0.57 0.00 0.00 179.45 179.93 3flk n GLN 69 N -2.40 0.75 -4.22 3.15 1.13 -1.16 -4.85 117.38 109.78 3flk n GLN 69 Ca 0.01 -0.00 -0.28 0.00 -1.94 0.00 0.00 57.00 54.79 3flk n GLN 69 Cb 0.20 -1.50 -0.09 0.00 0.11 0.00 0.00 30.24 28.96 3flk n GLN 69 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 3flk s TYR 70 N -2.25 2.78 0.14 1.08 2.02 -0.74 -4.93 117.35 115.45 3flk s TYR 70 Ca 0.39 -0.15 0.05 0.00 -0.37 0.00 0.00 57.07 56.99 3flk s TYR 70 Cb 0.21 -1.40 -0.11 0.00 -0.40 0.00 0.00 41.96 40.26 3flk s TYR 70 CO 0.41 0.48 1.32 -0.44 -1.57 0.00 0.00 175.55 175.75 3flk h ASP 71 N 3.14 0.11 -4.99 2.29 3.32 -1.27 -3.42 116.42 115.60 3flk h ASP 71 Ca -0.48 -0.11 0.02 0.00 0.02 0.00 0.00 57.03 56.49 3flk h ASP 71 Cb 1.19 -0.04 -0.10 0.00 0.22 0.00 0.00 39.33 40.60 3flk h ASP 71 CO 0.55 1.01 0.24 0.00 -1.72 0.00 0.00 179.24 179.32 3flk s ALA 72 N -2.91 -1.48 -0.17 3.45 0.00 -1.20 -4.24 121.76 115.20 3flk s ALA 72 Ca -0.01 0.23 -0.03 0.00 0.00 0.00 0.00 51.96 52.15 3flk s ALA 72 Cb 0.10 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 24.05 3flk s ALA 72 CO 0.82 -0.87 -0.06 0.42 0.00 0.00 0.00 175.76 176.08 3flk s ILE 73 N -3.77 3.49 -0.37 0.00 1.01 -0.00 -1.60 121.20 119.96 3flk s ILE 73 Ca 0.05 -0.48 -0.08 0.00 0.00 0.00 0.00 60.65 60.14 3flk s ILE 73 Cb -0.03 -2.54 0.05 0.00 0.01 0.00 0.00 42.46 39.96 3flk s ILE 73 CO -0.06 0.47 0.18 -0.47 0.00 0.00 0.00 174.94 175.06 3flk s TYR 74 N 0.79 3.29 -0.06 3.97 5.04 0.56 -0.13 117.35 130.81 3flk s TYR 74 Ca -0.02 -1.42 0.05 0.00 -2.44 0.00 0.00 57.07 53.24 3flk s TYR 74 Cb -0.15 -2.56 -0.02 0.00 0.35 0.00 0.00 41.96 39.58 3flk s TYR 74 CO 0.02 -0.76 -0.21 0.12 -1.34 0.00 0.00 175.55 173.37 3flk s PHE 75 N 1.42 2.53 0.00 4.97 5.36 0.23 -0.63 117.98 131.86 3flk s PHE 75 Ca 0.01 -0.55 0.00 0.00 -0.96 0.00 0.00 56.93 55.43 3flk s PHE 75 Cb -0.21 -1.62 0.00 0.00 -0.34 0.00 0.00 43.02 40.85 3flk s PHE 75 CO 0.03 -0.10 0.00 0.41 -1.46 0.00 0.00 175.22 174.10 3flk n GLY 76 N 2.81 1.64 3.50 13.12 0.00 -0.05 -4.18 105.19 122.03 3flk n GLY 76 Ca -0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 3flk n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3flk s ALA 77 N -4.00 -1.79 -0.03 4.61 0.00 -0.83 -4.37 121.76 115.34 3flk s ALA 77 Ca 0.00 1.07 0.03 0.00 0.00 0.00 0.00 51.96 53.05 3flk s ALA 77 Cb 0.00 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.36 3flk s ALA 77 CO 0.00 -0.59 -0.10 0.54 0.00 0.00 0.00 175.76 175.61 3flk s VAL 78 N -2.58 0.90 0.00 0.00 0.11 -1.26 0.13 120.40 117.70 3flk s VAL 78 Ca 0.01 -0.42 0.00 0.00 -2.93 0.00 0.00 61.98 58.63 3flk s VAL 78 Cb -0.01 -0.80 0.00 0.00 -1.53 0.00 0.00 36.38 34.04 3flk s VAL 78 CO -0.05 0.28 0.00 0.61 -3.33 0.00 0.00 175.10 172.61 3flk n GLY 79 N 3.29 4.44 2.66 6.54 0.00 -1.26 -4.59 105.19 116.26 3flk n GLY 79 Ca -0.18 -0.75 -0.13 0.00 0.00 0.00 0.00 46.02 44.96 3flk n GLY 79 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3flk s TRP 80 N -0.26 -0.57 0.63 1.61 -0.11 -1.26 -4.66 118.94 114.32 3flk s TRP 80 Ca 0.00 -1.16 0.40 0.00 1.22 0.00 0.00 56.10 56.56 3flk s TRP 80 Cb 0.00 -0.17 2.22 0.00 -1.50 0.00 0.00 33.47 34.02 3flk s TRP 80 CO 0.00 -1.09 2.33 -1.00 -4.62 0.00 0.00 176.95 172.57 3flk h PRO 81 N 5.52 0.00 0.00 5.86 0.13 -1.92 -0.14 132.00 141.44 3flk h PRO 81 Ca 0.13 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.25 3flk h PRO 81 Cb 1.04 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.17 3flk h PRO 81 CO 0.16 0.00 -0.04 0.22 -0.23 0.00 0.00 178.00 178.11 3flk h ASP 82 N 0.00 0.00 0.00 1.44 3.58 -2.00 -3.34 116.42 116.10 3flk h ASP 82 Ca -0.00 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.41 3flk h ASP 82 Cb 0.01 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.05 3flk h ASP 82 CO 0.00 0.04 -1.15 0.29 -2.88 0.00 0.00 179.24 175.53 3flk n LYS 83 N -4.43 2.94 -3.85 0.28 4.76 -0.38 -5.04 118.16 112.45 3flk n LYS 83 Ca -0.03 0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.25 3flk n LYS 83 Cb 0.12 -1.06 -0.16 0.00 -1.84 0.00 0.00 35.03 32.09 3flk n LYS 83 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3flk s VAL 84 N -2.05 0.08 0.39 -0.18 1.01 -0.21 -5.07 120.40 114.37 3flk s VAL 84 Ca -0.02 0.16 -0.25 0.00 0.00 0.00 0.00 61.98 61.87 3flk s VAL 84 Cb 0.01 -0.20 -0.11 0.00 0.00 0.00 0.00 36.38 36.07 3flk s VAL 84 CO 0.09 0.13 1.03 -2.65 0.00 0.00 0.00 175.10 173.70 3flk n PRO 85 N 4.29 1.42 0.01 2.72 -0.02 -1.26 -3.49 135.00 138.67 3flk n PRO 85 Ca -0.24 0.51 0.02 0.00 -2.02 0.00 0.00 63.50 61.76 3flk n PRO 85 Cb 0.50 -2.03 0.36 0.00 -0.02 0.00 0.00 33.50 32.31 3flk n PRO 85 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3flk h ASP 86 N 1.71 0.46 0.55 2.55 3.32 -1.92 -1.96 116.42 121.12 3flk h ASP 86 Ca -0.44 -0.05 -0.14 0.00 0.02 0.00 0.00 57.03 56.42 3flk h ASP 86 Cb 1.33 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.75 3flk h ASP 86 CO 0.58 0.45 -0.63 1.12 -1.72 0.00 0.00 179.24 179.03 3flk h HIS 87 N 0.50 0.11 -0.05 4.55 2.07 -2.00 -2.28 115.15 118.05 3flk h HIS 87 Ca 0.12 -0.04 -0.03 0.00 -2.85 0.00 0.00 60.37 57.56 3flk h HIS 87 Cb 0.16 -0.02 0.00 0.00 2.57 0.00 0.00 27.41 30.13 3flk h HIS 87 CO 0.01 0.69 -0.09 0.82 -3.07 0.00 0.00 177.93 176.28 3flk h ILE 88 N 0.06 1.41 -0.26 6.12 2.04 -1.80 -2.81 117.51 122.27 3flk h ILE 88 Ca -0.01 -1.38 -0.02 0.00 1.00 0.00 0.00 64.86 64.45 3flk h ILE 88 Cb 1.13 2.20 -0.01 0.00 -0.74 0.00 0.00 36.82 39.40 3flk h ILE 88 CO 0.09 0.38 0.09 0.77 0.00 0.00 0.00 178.15 179.47 3flk h SER 89 N -0.33 0.37 -0.12 1.72 4.64 -1.39 -1.46 113.55 116.97 3flk h SER 89 Ca 0.00 -0.19 -0.03 0.00 -0.47 0.00 0.00 61.79 61.10 3flk h SER 89 Cb 0.66 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3flk h SER 89 CO 0.02 0.46 -0.05 0.25 -0.87 0.00 0.00 176.83 176.64 3flk h LEU 90 N 0.25 0.25 -1.22 5.97 5.85 -1.53 -2.96 115.31 121.93 3flk h LEU 90 Ca 0.08 -0.41 -0.05 0.00 0.84 0.00 0.00 57.88 58.34 3flk h LEU 90 Cb 0.22 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 3flk h LEU 90 CO -0.00 0.60 -0.25 -0.50 -0.34 0.00 0.00 178.44 177.95 3flk h TRP 91 N -0.10 0.00 -0.00 1.25 4.06 -1.55 -1.87 115.95 117.73 3flk h TRP 91 Ca 0.03 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.98 3flk h TRP 91 Cb 0.51 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.67 3flk h TRP 91 CO 0.06 0.25 -0.14 0.41 -3.56 0.00 0.00 178.44 175.47 3flk n GLY 92 N -0.00 -0.90 0.00 1.49 0.00 -0.55 -4.13 105.19 101.10 3flk n GLY 92 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.73 3flk n GLY 92 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3flk n SER 93 N -0.92 0.00 -0.28 1.61 3.41 -1.07 -4.88 113.62 111.48 3flk n SER 93 Ca 0.14 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.70 3flk n SER 93 Cb 0.29 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.31 3flk n SER 93 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3flk h LEU 94 N 0.00 0.93 -1.32 1.04 5.85 -1.70 -2.07 115.31 118.04 3flk h LEU 94 Ca 0.00 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.59 3flk h LEU 94 Cb 0.00 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 3flk h LEU 94 CO 0.00 0.72 -0.31 -0.07 -0.34 0.00 0.00 178.44 178.44 3flk h LEU 95 N 1.06 0.05 -0.48 2.25 4.07 -1.61 -0.97 115.31 119.68 3flk h LEU 95 Ca 0.28 -0.01 -0.08 0.00 0.08 0.00 0.00 57.88 58.14 3flk h LEU 95 Cb -0.04 -0.01 -0.02 0.00 1.08 0.00 0.00 40.66 41.67 3flk h LEU 95 CO -0.05 0.36 -0.03 0.11 -1.08 0.00 0.00 178.44 177.74 3flk h LYS 96 N 0.04 0.87 0.02 1.13 1.57 -1.55 -1.76 116.57 116.89 3flk h LYS 96 Ca 0.00 -0.29 0.02 0.00 -1.87 0.00 0.00 60.65 58.51 3flk h LYS 96 Cb 0.57 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.78 3flk h LYS 96 CO 0.04 0.93 -0.14 0.74 -0.57 0.00 0.00 179.45 180.45 3flk h PHE 97 N 0.72 -0.36 -0.77 -1.35 0.04 -0.82 -0.35 116.94 114.05 3flk h PHE 97 Ca 0.13 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.90 3flk h PHE 97 Cb 0.56 0.16 -0.04 0.00 2.20 0.00 0.00 35.95 38.83 3flk h PHE 97 CO 0.04 -0.21 0.44 0.00 -0.60 0.00 0.00 178.31 177.98 3flk h ARG 98 N -0.24 1.06 0.09 1.51 3.08 -1.15 -2.28 114.38 116.45 3flk h ARG 98 Ca 0.04 -0.12 -0.27 0.00 0.07 0.00 0.00 59.98 59.71 3flk h ARG 98 Cb 0.29 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3flk h ARG 98 CO -0.12 0.78 -1.41 0.00 -1.07 0.00 0.00 179.97 178.15 3flk h ARG 99 N 1.06 0.18 0.00 0.04 3.08 -1.28 0.66 114.38 118.13 3flk h ARG 99 Ca 0.27 -0.31 -0.07 0.00 0.07 0.00 0.00 59.98 59.94 3flk h ARG 99 Cb 0.01 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 3flk h ARG 99 CO -0.05 1.15 -0.34 0.93 -1.07 0.00 0.00 179.97 180.59 3flk h GLU 100 N -0.43 0.00 -0.62 0.04 5.08 -1.15 -2.42 114.58 115.08 3flk h GLU 100 Ca -0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 3flk h GLU 100 Cb 1.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.92 3flk h GLU 100 CO 0.00 0.34 0.00 1.19 -1.00 0.00 0.00 179.01 179.54 3flk n PHE 101 N -3.34 0.94 -4.12 4.33 3.72 -0.86 -4.97 117.46 113.17 3flk n PHE 101 Ca 0.01 -0.43 -0.29 0.00 -0.05 0.00 0.00 57.45 56.68 3flk n PHE 101 Cb 0.56 -0.06 -0.05 0.00 -0.94 0.00 0.00 39.48 38.99 3flk n PHE 101 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3flk n ASP 102 N 1.19 -0.12 -3.70 4.37 2.03 -0.91 -4.63 116.55 114.78 3flk n ASP 102 Ca 0.21 -1.15 -0.42 0.00 0.52 0.00 0.00 54.79 53.95 3flk n ASP 102 Cb 0.58 -2.32 -0.00 0.00 -0.72 0.00 0.00 41.12 38.66 3flk n ASP 102 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3flk n GLN 103 N -4.52 3.68 0.26 -0.67 6.02 0.22 -4.38 117.38 117.99 3flk n GLN 103 Ca -0.30 -3.18 0.16 0.00 -0.01 0.00 0.00 57.00 53.66 3flk n GLN 103 Cb 0.68 -2.92 0.57 0.00 1.02 0.00 0.00 30.24 29.59 3flk n GLN 103 CO 0.00 0.00 0.00 0.10 -1.01 0.00 0.00 177.06 176.15 3flk h TYR 104 N 5.47 0.00 -3.79 1.08 -0.00 -1.72 -3.39 116.97 114.62 3flk h TYR 104 Ca 0.55 0.00 -0.66 0.00 0.00 0.00 0.00 58.73 58.62 3flk h TYR 104 Cb 0.52 0.00 -0.19 0.00 0.00 0.00 0.00 36.73 37.07 3flk h TYR 104 CO 1.44 0.02 -0.52 0.08 -0.00 0.00 0.00 178.16 179.17 3flk s VAL 105 N -3.58 5.12 -0.43 -0.90 1.01 -1.12 -1.65 120.40 118.87 3flk s VAL 105 Ca 0.02 -0.05 -0.07 0.00 0.00 0.00 0.00 61.98 61.88 3flk s VAL 105 Cb 0.08 -3.51 0.10 0.00 0.00 0.00 0.00 36.38 33.04 3flk s VAL 105 CO 0.57 0.16 0.26 0.21 0.00 0.00 0.00 175.10 176.30 3flk s ASN 106 N 1.72 5.54 -0.23 3.32 3.84 -0.31 -0.32 114.94 128.49 3flk s ASN 106 Ca 0.06 -1.72 -0.16 0.00 0.21 0.00 0.00 52.86 51.26 3flk s ASN 106 Cb -0.16 -1.95 -0.04 0.00 -0.55 0.00 0.00 41.25 38.55 3flk s ASN 106 CO 0.10 -0.57 0.40 -0.63 -2.79 0.00 0.00 177.10 173.61 3flk s ILE 107 N 1.34 5.17 -0.34 -5.21 -1.09 -0.05 -0.93 121.20 120.09 3flk s ILE 107 Ca 0.04 0.68 -0.01 0.00 -2.23 0.00 0.00 60.65 59.13 3flk s ILE 107 Cb -0.24 -3.73 0.12 0.00 -1.58 0.00 0.00 42.46 37.03 3flk s ILE 107 CO -0.00 0.20 0.16 -0.13 -1.23 0.00 0.00 174.94 173.94 3flk s ARG 108 N 1.70 0.64 0.41 2.79 0.52 -0.38 -1.05 118.95 123.59 3flk s ARG 108 Ca 0.18 -1.17 -0.24 0.00 -0.52 0.00 0.00 55.73 53.97 3flk s ARG 108 Cb -0.15 -1.66 -0.08 0.00 0.52 0.00 0.00 34.95 33.57 3flk s ARG 108 CO 0.09 -1.09 1.13 -1.25 0.02 0.00 0.00 175.30 174.20 3flk s PRO 109 N 1.37 4.01 -0.12 3.54 0.04 -1.26 -1.56 135.00 141.01 3flk s PRO 109 Ca 0.13 1.72 0.02 0.00 0.04 0.00 0.00 61.00 62.91 3flk s PRO 109 Cb -0.20 -2.57 0.01 0.00 0.04 0.00 0.00 34.50 31.79 3flk s PRO 109 CO -0.17 -0.33 -0.17 0.08 0.04 0.00 0.00 177.00 176.46 3flk s VAL 110 N -1.52 1.65 -0.14 -0.36 1.01 0.89 -4.59 120.40 117.35 3flk s VAL 110 Ca 0.59 -0.73 -0.10 0.00 0.00 0.00 0.00 61.98 61.74 3flk s VAL 110 Cb -0.28 -1.50 0.05 0.00 0.00 0.00 0.00 36.38 34.65 3flk s VAL 110 CO 0.34 0.47 0.35 -0.60 0.00 0.00 0.00 175.10 175.66 3flk s ARG 111 N 0.99 0.36 -0.31 2.72 3.52 -1.26 -1.35 118.95 123.62 3flk s ARG 111 Ca -0.06 0.60 -0.18 0.00 -0.13 0.00 0.00 55.73 55.97 3flk s ARG 111 Cb -0.15 0.05 -0.02 0.00 -1.56 0.00 0.00 34.95 33.28 3flk s ARG 111 CO -0.03 -0.11 0.51 -1.17 -0.81 0.00 0.00 175.30 173.69 3flk s LEU 112 N 0.85 4.20 0.26 -0.88 2.96 -0.55 -4.92 118.68 120.60 3flk s LEU 112 Ca -0.05 0.21 -0.11 0.00 -0.22 0.00 0.00 54.13 53.96 3flk s LEU 112 Cb -0.06 -2.61 -0.08 0.00 0.50 0.00 0.00 46.19 43.95 3flk s LEU 112 CO -0.06 -0.39 0.60 -0.36 -1.32 0.00 0.00 176.35 174.82 3flk s PHE 113 N 2.35 3.41 0.29 5.38 0.08 -1.26 -4.57 117.98 123.66 3flk s PHE 113 Ca 0.19 0.95 -0.30 0.00 0.12 0.00 0.00 56.93 57.90 3flk s PHE 113 Cb -0.15 -2.32 -0.12 0.00 -0.57 0.00 0.00 43.02 39.85 3flk s PHE 113 CO 0.12 0.22 1.56 -2.30 -0.10 0.00 0.00 175.22 174.72 3flk n PRO 114 N -0.23 2.62 -0.17 0.24 -0.02 -1.26 -2.76 135.00 133.42 3flk n PRO 114 Ca 0.01 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 3flk n PRO 114 Cb 0.53 -2.69 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 3flk n PRO 114 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3flk n GLY 115 N 2.01 0.70 3.74 -1.23 0.00 -1.26 -3.88 105.19 105.26 3flk n GLY 115 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 3flk n GLY 115 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3flk s VAL 116 N -2.43 5.02 -0.42 1.61 1.01 -1.11 -4.86 120.40 119.21 3flk s VAL 116 Ca 0.00 1.22 -0.28 0.00 0.00 0.00 0.00 61.98 62.92 3flk s VAL 116 Cb 0.00 -3.93 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 3flk s VAL 116 CO 0.00 0.35 1.76 -2.84 0.00 0.00 0.00 175.10 174.38 3flk s PRO 117 N 0.25 3.17 0.27 2.72 0.02 -1.26 -4.97 135.00 135.20 3flk s PRO 117 Ca 0.31 1.14 -0.29 0.00 0.02 0.00 0.00 61.00 62.18 3flk s PRO 117 Cb -0.17 -4.23 -0.09 0.00 0.02 0.00 0.00 34.50 30.03 3flk s PRO 117 CO 0.16 -2.06 1.24 0.00 -0.33 0.00 0.00 177.00 176.01 3flk h ALA 119 N 4.21 1.08 -2.67 0.00 0.00 -1.77 -3.44 119.26 116.67 3flk h ALA 119 Ca -0.47 -0.23 -0.62 0.00 0.00 0.00 0.00 54.91 53.59 3flk h ALA 119 Cb 1.22 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.91 3flk h ALA 119 CO 0.70 0.31 -0.28 -0.51 0.00 0.00 0.00 179.25 179.47 3flk s LEU 120 N -7.02 4.44 0.38 0.00 1.43 -1.25 -5.07 118.68 111.60 3flk s LEU 120 Ca -0.00 0.81 -0.23 0.00 -1.03 0.00 0.00 54.13 53.67 3flk s LEU 120 Cb 0.11 -2.53 -0.10 0.00 0.03 0.00 0.00 46.19 43.70 3flk s LEU 120 CO 0.64 0.32 0.97 0.00 0.23 0.00 0.00 176.35 178.51 3flk s ALA 121 N -1.12 3.11 -1.45 4.21 0.00 -1.26 -4.08 121.76 121.17 3flk s ALA 121 Ca 0.23 0.50 -0.08 0.00 0.00 0.00 0.00 51.96 52.61 3flk s ALA 121 Cb -0.15 -3.19 0.02 0.00 0.00 0.00 0.00 23.12 19.80 3flk s ALA 121 CO 0.12 0.08 0.94 0.09 0.00 0.00 0.00 175.76 176.99 3flk n ASN 122 N -0.09 -6.04 -4.32 0.00 5.03 -1.26 -5.00 115.26 103.58 3flk n ASN 122 Ca 0.05 -0.48 -0.32 0.00 0.87 0.00 0.00 54.58 54.70 3flk n ASN 122 Cb 0.52 -4.81 -0.16 0.00 -1.02 0.00 0.00 39.78 34.31 3flk n ASN 122 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 3flk s ARG 123 N -6.14 2.66 0.31 3.52 3.00 -1.26 -5.14 118.95 115.91 3flk s ARG 123 Ca 0.50 -0.83 0.08 0.00 0.00 0.00 0.00 55.73 55.47 3flk s ARG 123 Cb -0.22 -2.27 -0.04 0.00 0.00 0.00 0.00 34.95 32.42 3flk s ARG 123 CO 0.61 0.40 0.14 -1.59 0.00 0.00 0.00 175.30 174.87 3flk s LYS 124 N -0.20 2.49 0.20 3.54 -2.85 -1.26 -4.99 119.74 116.68 3flk s LYS 124 Ca -0.02 -1.41 -0.32 0.00 -1.00 0.00 0.00 55.97 53.22 3flk s LYS 124 Cb -0.13 -2.28 -0.12 0.00 -2.06 0.00 0.00 37.83 33.23 3flk s LYS 124 CO 0.03 0.21 1.68 0.28 0.10 0.00 0.00 175.35 177.65 3flk n VAL 125 N -1.13 0.08 0.00 1.79 0.31 -1.26 -1.86 118.33 116.26 3flk n VAL 125 Ca -0.04 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 3flk n VAL 125 Cb 0.60 -1.88 0.00 0.00 -0.91 0.00 0.00 33.84 31.65 3flk n VAL 125 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3flk n GLY 126 N 3.71 1.33 0.18 2.92 0.00 -1.26 -4.93 105.19 107.14 3flk n GLY 126 Ca 0.16 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.22 3flk n GLY 126 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3flk h ASP 127 N 1.29 0.00 -3.99 1.61 3.32 -1.76 -3.38 116.42 113.51 3flk h ASP 127 Ca 0.00 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.41 3flk h ASP 127 Cb 0.00 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.14 3flk h ASP 127 CO 0.00 0.40 -0.68 -0.63 -1.72 0.00 0.00 179.24 176.61 3flk s ILE 128 N -3.77 2.27 -0.40 0.35 1.01 -1.26 -2.13 121.20 117.27 3flk s ILE 128 Ca -0.01 -2.80 0.06 0.00 0.00 0.00 0.00 60.65 57.89 3flk s ILE 128 Cb 0.12 -2.62 0.17 0.00 0.01 0.00 0.00 42.46 40.14 3flk s ILE 128 CO 0.70 -0.73 0.51 -0.62 0.00 0.00 0.00 174.94 174.80 3flk s ASP 129 N 0.29 -0.17 0.28 3.58 -1.08 -1.25 -1.48 116.67 116.84 3flk s ASP 129 Ca 0.15 -1.34 -0.03 0.00 -0.52 0.00 0.00 52.55 50.81 3flk s ASP 129 Cb -0.23 1.22 -0.01 0.00 -1.46 0.00 0.00 42.92 42.43 3flk s ASP 129 CO -0.04 -0.20 0.36 0.72 0.52 0.00 0.00 175.17 176.53 3flk s PHE 130 N 1.48 1.02 -0.07 -5.34 -0.12 -0.46 -4.66 117.98 109.84 3flk s PHE 130 Ca 0.18 -1.23 0.02 0.00 -0.05 0.00 0.00 56.93 55.85 3flk s PHE 130 Cb -0.09 -0.23 0.02 0.00 -0.63 0.00 0.00 43.02 42.09 3flk s PHE 130 CO -0.05 -0.94 -0.11 0.54 -0.05 0.00 0.00 175.22 174.62 3flk s VAL 131 N -3.63 1.03 -0.19 -2.49 0.11 0.38 -0.08 120.40 115.53 3flk s VAL 131 Ca 0.32 -0.40 -0.19 0.00 -2.93 0.00 0.00 61.98 58.78 3flk s VAL 131 Cb 0.02 -0.96 -0.03 0.00 -1.53 0.00 0.00 36.38 33.88 3flk s VAL 131 CO 0.16 0.34 0.56 -0.69 -3.33 0.00 0.00 175.10 172.14 3flk s VAL 132 N 0.81 5.08 -0.39 2.04 1.01 -0.60 -0.60 120.40 127.74 3flk s VAL 132 Ca -0.12 1.05 -0.08 0.00 0.00 0.00 0.00 61.98 62.82 3flk s VAL 132 Cb -0.15 -3.88 0.06 0.00 0.00 0.00 0.00 36.38 32.41 3flk s VAL 132 CO 0.02 0.17 0.21 -0.69 0.00 0.00 0.00 175.10 174.80 3flk s VAL 133 N 1.64 4.13 -0.17 2.92 1.01 0.15 -1.24 120.40 128.84 3flk s VAL 133 Ca 0.26 -1.26 -0.04 0.00 0.00 0.00 0.00 61.98 60.95 3flk s VAL 133 Cb -0.16 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 3flk s VAL 133 CO 0.10 -0.38 -0.03 -0.60 0.00 0.00 0.00 175.10 174.19 3flk s ARG 134 N 1.43 3.63 0.20 2.72 3.52 -0.11 -1.57 118.95 128.78 3flk s ARG 134 Ca 0.02 -0.53 -0.31 0.00 -0.13 0.00 0.00 55.73 54.78 3flk s ARG 134 Cb -0.21 -2.95 -0.10 0.00 -1.56 0.00 0.00 34.95 30.12 3flk s ARG 134 CO 0.03 0.16 1.51 -2.00 -0.81 0.00 0.00 175.30 174.19 3flk s GLU 135 N 0.59 4.23 0.00 5.12 -6.30 -0.48 -1.16 118.70 120.69 3flk s GLU 135 Ca -0.02 2.34 0.00 0.00 -2.50 0.00 0.00 54.97 54.79 3flk s GLU 135 Cb -0.14 -3.13 0.00 0.00 0.00 0.00 0.00 34.13 30.86 3flk s GLU 135 CO 0.02 -0.53 0.72 -1.71 0.02 0.00 0.00 175.26 173.78 3flk n ASN 136 N 3.21 1.41 0.00 -1.70 5.15 -0.66 -3.06 115.26 119.61 3flk n ASN 136 Ca 0.11 -1.47 0.00 0.00 -0.60 0.00 0.00 54.58 52.61 3flk n ASN 136 Cb 0.39 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.64 3flk n ASN 136 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 3flk n THR 137 N -0.24 0.00 -2.21 -0.44 -2.24 -1.26 -4.65 114.28 103.24 3flk n THR 137 Ca 0.00 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 3flk n THR 137 Cb 0.14 0.97 0.00 0.00 -2.10 0.00 0.00 70.33 69.35 3flk n THR 137 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 3flk n GLU 138 N -0.57 0.00 0.00 -0.78 0.28 -1.26 -4.98 120.64 113.33 3flk n GLU 138 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 3flk n GLU 138 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 3flk n GLU 138 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3flk n GLY 139 N 0.00 0.59 0.15 -1.84 0.00 0.49 -4.22 105.19 100.36 3flk n GLY 139 Ca 0.00 -1.13 0.02 0.00 0.00 0.00 0.00 46.02 44.91 3flk n GLY 139 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3flk h GLU 140 N 0.00 0.00 -6.66 1.61 3.07 -1.91 -2.94 114.58 107.74 3flk h GLU 140 Ca 0.00 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 58.30 3flk h GLU 140 Cb 0.00 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 27.84 3flk h GLU 140 CO 0.00 0.53 0.96 0.71 -1.40 0.00 0.00 179.01 179.82 3flk s TYR 141 N -3.21 2.70 -0.01 4.33 2.02 -1.26 -4.86 117.35 117.06 3flk s TYR 141 Ca 0.02 0.65 -0.13 0.00 -0.37 0.00 0.00 57.07 57.23 3flk s TYR 141 Cb 0.09 -4.44 0.02 0.00 -0.40 0.00 0.00 41.96 37.23 3flk s TYR 141 CO 0.73 -1.45 0.27 0.45 -1.57 0.00 0.00 175.55 173.98 3flk s SER 142 N 2.83 -0.15 -0.16 2.29 0.15 -1.26 -4.84 113.70 112.56 3flk s SER 142 Ca 0.49 0.03 0.17 0.00 0.70 0.00 0.00 55.95 57.34 3flk s SER 142 Cb -0.08 0.30 0.36 0.00 -1.71 0.00 0.00 66.02 64.89 3flk s SER 142 CO 0.31 -0.42 1.22 -1.54 1.20 0.00 0.00 173.24 174.01 3flk n SER 143 N 1.36 2.53 -4.76 5.45 3.41 -1.26 -4.98 113.62 115.36 3flk n SER 143 Ca -0.22 -3.23 -0.37 0.00 -0.26 0.00 0.00 58.87 54.79 3flk n SER 143 Cb 0.56 -0.48 -0.07 0.00 -0.26 0.00 0.00 64.21 63.97 3flk n SER 143 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3flk s LEU 144 N -2.94 4.29 0.00 1.04 1.43 -1.26 -4.90 118.68 116.33 3flk s LEU 144 Ca 0.35 0.59 0.00 0.00 -1.03 0.00 0.00 54.13 54.04 3flk s LEU 144 Cb 0.31 -2.40 0.00 0.00 0.03 0.00 0.00 46.19 44.13 3flk s LEU 144 CO 0.02 0.15 0.00 0.61 0.23 0.00 0.00 176.35 177.37 3flk n GLY 145 N 3.02 0.25 0.00 -3.19 0.00 -1.26 -1.14 105.19 102.88 3flk n GLY 145 Ca -0.13 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.35 3flk n GLY 145 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3flk n GLY 146 N 0.00 -0.07 2.53 -0.02 0.00 -0.34 -4.99 105.19 102.30 3flk n GLY 146 Ca 0.00 -1.47 -0.22 0.00 0.00 0.00 0.00 46.02 44.34 3flk n GLY 146 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3flk n ILE 147 N 9.00 0.00 -0.73 -0.61 3.06 -1.26 -0.86 119.36 127.96 3flk n ILE 147 Ca 0.00 -1.70 0.00 0.00 -2.50 0.00 0.00 62.75 58.55 3flk n ILE 147 Cb 0.00 0.41 0.00 0.00 0.54 0.00 0.00 39.64 40.59 3flk n ILE 147 CO 0.00 0.00 0.00 0.49 -2.50 0.00 0.00 176.55 174.54 3flk n PHE 149 N -0.83 0.00 -1.66 9.51 3.72 -1.26 -4.99 117.46 121.95 3flk n PHE 149 Ca -0.12 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.85 3flk n PHE 149 Cb 0.45 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.98 3flk n PHE 149 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3flk n GLU 150 N -0.25 1.83 -1.36 -1.08 2.13 -1.26 -2.48 120.64 118.17 3flk n GLU 150 Ca 0.00 0.64 -0.12 0.00 0.66 0.00 0.00 57.16 58.34 3flk n GLU 150 Cb 0.00 -2.17 -0.05 0.00 0.27 0.00 0.00 31.44 29.49 3flk n GLU 150 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3flk n ASN 151 N 0.85 -4.56 -4.45 4.31 3.02 -1.26 -4.98 115.26 108.19 3flk n ASN 151 Ca 0.07 0.31 -0.22 0.00 -0.03 0.00 0.00 54.58 54.71 3flk n ASN 151 Cb 0.35 -3.16 -0.11 0.00 -0.61 0.00 0.00 39.78 36.25 3flk n ASN 151 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3flk s THR 152 N -2.44 1.49 0.60 3.41 -4.23 -1.03 -5.03 115.64 108.40 3flk s THR 152 Ca 0.00 -2.06 0.32 0.00 -1.18 0.00 0.00 61.69 58.77 3flk s THR 152 Cb 0.00 -2.63 0.37 0.00 1.34 0.00 0.00 72.50 71.57 3flk s THR 152 CO 0.00 -0.16 2.23 -0.08 -0.54 0.00 0.00 174.62 176.08 3flk h GLU 153 N 2.17 0.00 -0.22 3.99 4.81 -1.95 -2.16 114.58 121.22 3flk h GLU 153 Ca -0.41 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 3flk h GLU 153 Cb 1.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.62 3flk h GLU 153 CO 0.70 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 179.07 3flk n ASN 154 N -3.70 1.91 -4.64 1.04 3.02 -1.26 -4.97 115.26 106.66 3flk n ASN 154 Ca -0.02 -1.78 -0.52 0.00 -0.03 0.00 0.00 54.58 52.23 3flk n ASN 154 Cb 0.14 -0.14 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 3flk n ASN 154 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 3flk n GLU 155 N 0.49 1.35 -4.75 3.52 2.13 -0.82 -4.75 120.64 117.81 3flk n GLU 155 Ca 0.16 0.49 -0.24 0.00 0.66 0.00 0.00 57.16 58.23 3flk n GLU 155 Cb 0.36 -2.17 -0.16 0.00 0.27 0.00 0.00 31.44 29.74 3flk n GLU 155 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3flk s ILE 156 N 1.56 1.29 -0.12 6.31 1.01 -1.26 -5.02 121.20 124.97 3flk s ILE 156 Ca 0.88 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 60.89 3flk s ILE 156 Cb -0.93 -1.09 0.01 0.00 0.01 0.00 0.00 42.46 40.45 3flk s ILE 156 CO 0.51 0.37 -0.21 -0.69 0.00 0.00 0.00 174.94 174.92 3flk s VAL 157 N -0.12 1.90 -0.06 2.92 1.01 -1.26 -4.35 120.40 120.44 3flk s VAL 157 Ca 0.01 -0.90 0.05 0.00 0.00 0.00 0.00 61.98 61.13 3flk s VAL 157 Cb -0.09 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 3flk s VAL 157 CO 0.01 0.52 -0.20 -0.63 0.00 0.00 0.00 175.10 174.80 3flk s ILE 158 N 0.70 2.52 -0.08 2.22 1.01 -0.04 -5.00 121.20 122.54 3flk s ILE 158 Ca -0.11 -0.91 -0.01 0.00 0.00 0.00 0.00 60.65 59.62 3flk s ILE 158 Cb -0.16 -1.96 0.03 0.00 0.01 0.00 0.00 42.46 40.38 3flk s ILE 158 CO 0.02 0.57 -0.01 -1.58 0.00 0.00 0.00 174.94 173.94 3flk s GLN 159 N -0.35 0.76 0.04 2.79 2.00 -1.26 -1.20 119.66 122.44 3flk s GLN 159 Ca 0.03 0.04 -0.14 0.00 -2.00 0.00 0.00 55.36 53.28 3flk s GLN 159 Cb -0.12 -1.06 -0.06 0.00 0.80 0.00 0.00 33.01 32.57 3flk s GLN 159 CO 0.02 -0.29 0.44 -1.21 -0.50 0.00 0.00 175.29 173.76 3flk s GLU 160 N 1.88 3.93 -0.15 1.67 8.01 -0.30 -5.00 118.70 128.75 3flk s GLU 160 Ca 0.04 0.42 -0.01 0.00 0.01 0.00 0.00 54.97 55.44 3flk s GLU 160 Cb -0.12 -3.15 -0.01 0.00 -4.31 0.00 0.00 34.13 26.54 3flk s GLU 160 CO -0.05 0.64 -0.12 -1.12 0.01 0.00 0.00 175.26 174.61 3flk s SER 161 N -1.28 3.96 -0.16 -0.19 0.01 -1.26 -4.66 113.70 110.12 3flk s SER 161 Ca 0.28 -0.38 -0.01 0.00 1.31 0.00 0.00 55.95 57.15 3flk s SER 161 Cb -0.16 -1.62 -0.01 0.00 0.21 0.00 0.00 66.02 64.44 3flk s SER 161 CO 0.16 0.11 -0.12 -0.63 0.41 0.00 0.00 173.24 173.16 3flk s ILE 162 N 0.68 2.94 -0.04 1.44 -1.09 -1.11 -4.98 121.20 119.04 3flk s ILE 162 Ca -0.06 -0.68 0.06 0.00 -2.23 0.00 0.00 60.65 57.74 3flk s ILE 162 Cb -0.15 -2.26 -0.01 0.00 -1.58 0.00 0.00 42.46 38.46 3flk s ILE 162 CO 0.02 0.50 -0.21 -0.36 -1.23 0.00 0.00 174.94 173.66 3flk s PHE 163 N 0.76 2.07 0.20 3.97 0.08 -1.26 -0.38 117.98 123.42 3flk s PHE 163 Ca -0.05 -0.56 0.11 0.00 0.12 0.00 0.00 56.93 56.55 3flk s PHE 163 Cb -0.15 -1.36 -0.04 0.00 -0.57 0.00 0.00 43.02 40.89 3flk s PHE 163 CO 0.01 -0.16 -0.20 0.95 -0.10 0.00 0.00 175.22 175.73 3flk s THR 164 N -0.17 2.58 0.20 0.64 -4.23 -1.26 -5.03 115.64 108.37 3flk s THR 164 Ca -0.01 -1.99 -0.11 0.00 -1.18 0.00 0.00 61.69 58.39 3flk s THR 164 Cb -0.12 -2.27 0.12 0.00 1.34 0.00 0.00 72.50 71.58 3flk s THR 164 CO 0.02 -0.16 1.85 -0.09 -0.54 0.00 0.00 174.62 175.71 3flk h ARG 165 N 2.99 0.82 0.13 3.99 2.43 -2.01 -0.51 114.38 122.21 3flk h ARG 165 Ca -0.46 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 58.68 3flk h ARG 165 Cb 1.21 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.56 3flk h ARG 165 CO 0.51 0.54 -0.18 0.00 -1.51 0.00 0.00 179.97 179.33 3flk h ARG 166 N 0.84 -0.35 -0.51 0.20 3.08 -1.99 0.52 114.38 116.17 3flk h ARG 166 Ca 0.25 0.02 -0.10 0.00 0.07 0.00 0.00 59.98 60.22 3flk h ARG 166 Cb -0.04 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 3flk h ARG 166 CO -0.08 -0.23 -0.08 0.78 -1.07 0.00 0.00 179.97 179.29 3flk h GLY 167 N -0.36 1.04 0.68 0.04 0.00 -1.95 -2.49 103.07 100.01 3flk h GLY 167 Ca 0.02 -0.82 -0.03 0.00 0.00 0.00 0.00 47.33 46.50 3flk h GLY 167 CO -0.08 0.76 -0.05 -2.08 0.00 0.00 0.00 176.54 175.08 3flk h VAL 168 N 0.82 1.33 -0.70 4.60 2.07 -1.03 -3.04 116.25 120.30 3flk h VAL 168 Ca 0.13 -1.08 0.01 0.00 0.82 0.00 0.00 66.70 66.59 3flk h VAL 168 Cb 0.63 1.86 -0.04 0.00 -1.52 0.00 0.00 31.29 32.22 3flk h VAL 168 CO 0.04 0.30 0.45 0.44 0.02 0.00 0.00 177.57 178.83 3flk h ASP 169 N -0.18 0.77 0.09 0.57 5.19 -0.92 -2.35 116.42 119.60 3flk h ASP 169 Ca 0.02 -0.01 -0.13 0.00 -0.62 0.00 0.00 57.03 56.29 3flk h ASP 169 Cb 0.50 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.82 3flk h ASP 169 CO 0.01 0.55 -0.43 0.08 -3.12 0.00 0.00 179.24 176.34 3flk h ARG 170 N 0.91 0.42 -0.21 3.56 0.11 -1.50 0.62 114.38 118.29 3flk h ARG 170 Ca 0.26 -0.22 -0.20 0.00 0.10 0.00 0.00 59.98 59.93 3flk h ARG 170 Cb -0.07 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.02 3flk h ARG 170 CO -0.07 0.78 -0.65 0.97 0.10 0.00 0.00 179.97 181.09 3flk h ILE 171 N 0.35 1.29 -0.51 0.08 6.09 -1.45 -2.34 117.51 121.01 3flk h ILE 171 Ca 0.03 -1.86 -0.07 0.00 -1.37 0.00 0.00 64.86 61.59 3flk h ILE 171 Cb 0.90 1.81 -0.02 0.00 0.47 0.00 0.00 36.82 39.98 3flk h ILE 171 CO 0.08 0.59 0.06 -0.07 -3.07 0.00 0.00 178.15 175.74 3flk h LEU 172 N 0.57 0.84 -0.26 2.19 3.38 -1.24 -2.11 115.31 118.68 3flk h LEU 172 Ca -0.02 -0.28 0.01 0.00 0.09 0.00 0.00 57.88 57.69 3flk h LEU 172 Cb 1.26 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 3flk h LEU 172 CO 0.14 0.90 0.16 0.50 0.09 0.00 0.00 178.44 180.23 3flk h LYS 173 N 0.75 0.31 -0.41 1.13 3.64 -0.90 -1.19 116.57 119.90 3flk h LYS 173 Ca 0.15 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.56 3flk h LYS 173 Cb 0.44 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.14 3flk h LYS 173 CO 0.01 0.21 0.15 -0.92 -2.27 0.00 0.00 179.45 176.63 3flk h TYR 174 N 0.32 0.26 -0.61 1.91 3.20 -1.28 0.58 116.97 121.35 3flk h TYR 174 Ca 0.10 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.94 3flk h TYR 174 Cb -0.02 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.17 3flk h TYR 174 CO -0.07 0.10 0.22 0.00 -1.64 0.00 0.00 178.16 176.77 3flk h ALA 175 N 1.26 0.80 -0.32 1.82 0.00 -1.13 -0.22 119.26 121.47 3flk h ALA 175 Ca 0.19 -0.19 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 3flk h ALA 175 Cb 0.17 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3flk h ALA 175 CO -0.19 0.45 -0.46 0.74 0.00 0.00 0.00 179.25 179.78 3flk h PHE 176 N 0.87 1.03 -0.80 0.00 0.04 -1.00 -1.25 116.94 115.83 3flk h PHE 176 Ca 0.20 -0.33 0.02 0.00 2.80 0.00 0.00 57.97 60.66 3flk h PHE 176 Cb 0.25 -0.21 -0.04 0.00 2.20 0.00 0.00 35.95 38.15 3flk h PHE 176 CO 0.02 1.14 0.52 -0.44 -0.60 0.00 0.00 178.31 178.94 3flk h ASP 177 N 0.67 0.87 -0.18 2.17 3.32 -0.69 -1.18 116.42 121.40 3flk h ASP 177 Ca 0.04 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 3flk h ASP 177 Cb 1.05 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.39 3flk h ASP 177 CO 0.10 0.61 0.05 0.25 -1.72 0.00 0.00 179.24 178.53 3flk h LEU 178 N 1.03 0.26 -1.03 1.55 5.85 -0.91 -2.86 115.31 119.20 3flk h LEU 178 Ca 0.31 -0.22 0.06 0.00 0.84 0.00 0.00 57.88 58.86 3flk h LEU 178 Cb -0.04 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 40.85 3flk h LEU 178 CO -0.09 0.42 0.65 0.00 -0.34 0.00 0.00 178.44 179.07 3flk h ALA 179 N 0.86 1.40 -0.87 1.25 0.00 -1.06 -2.16 119.26 118.67 3flk h ALA 179 Ca 0.06 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.96 3flk h ALA 179 Cb 0.25 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 3flk h ALA 179 CO -0.00 0.47 0.58 1.49 0.00 0.00 0.00 179.25 181.78 3flk h GLU 180 N 1.19 1.10 0.00 0.00 4.57 -1.06 -2.18 114.58 118.20 3flk h GLU 180 Ca 0.42 -0.07 -0.03 0.00 -1.18 0.00 0.00 59.36 58.51 3flk h GLU 180 Cb 0.12 -0.25 -0.00 0.00 -0.16 0.00 0.00 28.75 28.46 3flk h GLU 180 CO -0.16 0.73 -0.13 0.87 -1.18 0.00 0.00 179.01 179.14 3flk h LYS 181 N 1.13 0.00 -6.99 1.92 1.57 -1.18 -3.46 116.57 109.56 3flk h LYS 181 Ca 0.33 0.00 -0.48 0.00 -1.87 0.00 0.00 60.65 58.63 3flk h LYS 181 Cb -0.05 0.00 0.04 0.00 0.08 0.00 0.00 32.23 32.30 3flk h LYS 181 CO -0.09 0.13 0.12 1.03 -0.57 0.00 0.00 179.45 180.07 3flk s ARG 182 N -3.46 3.18 0.22 3.15 0.52 -0.82 -5.01 118.95 116.73 3flk s ARG 182 Ca 0.03 0.01 -0.04 0.00 -0.52 0.00 0.00 55.73 55.22 3flk s ARG 182 Cb 0.08 -2.35 0.20 0.00 0.52 0.00 0.00 34.95 33.40 3flk s ARG 182 CO 0.63 -0.45 1.62 1.49 0.02 0.00 0.00 175.30 178.61 3flk h GLU 183 N 0.05 0.71 0.00 3.54 4.57 -1.89 -3.25 114.58 118.32 3flk h GLU 183 Ca -0.46 -0.31 -0.07 0.00 -1.18 0.00 0.00 59.36 57.35 3flk h GLU 183 Cb 1.24 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.79 3flk h GLU 183 CO 0.61 0.91 -0.65 0.00 -1.18 0.00 0.00 179.01 178.69 3flk h ARG 184 N 0.61 0.00 -6.45 1.92 3.08 -1.95 -3.49 114.38 108.11 3flk h ARG 184 Ca 0.08 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.66 3flk h ARG 184 Cb 0.78 0.00 0.05 0.00 0.08 0.00 0.00 29.97 30.88 3flk h ARG 184 CO 0.06 0.21 -0.94 1.63 -1.07 0.00 0.00 179.97 179.87 3flk n LYS 185 N -3.00 -0.95 -3.74 0.04 5.02 -1.23 -4.81 118.16 109.48 3flk n LYS 185 Ca -0.00 0.41 -0.15 0.00 -2.02 0.00 0.00 58.31 56.55 3flk n LYS 185 Cb 0.66 -3.55 -0.15 0.00 -0.02 0.00 0.00 35.03 31.96 3flk n LYS 185 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3flk s HIS 186 N -3.42 -0.07 -0.13 2.13 2.46 -1.26 -0.79 115.29 114.21 3flk s HIS 186 Ca 0.43 0.34 0.02 0.00 0.47 0.00 0.00 55.06 56.32 3flk s HIS 186 Cb -0.18 -0.19 -0.00 0.00 -0.13 0.00 0.00 32.58 32.08 3flk s HIS 186 CO 0.89 -0.15 -0.20 0.08 -2.47 0.00 0.00 174.74 172.90 3flk s VAL 187 N 1.31 2.38 -0.20 0.89 1.01 0.10 -2.46 120.40 123.43 3flk s VAL 187 Ca -0.07 -0.89 -0.06 0.00 0.00 0.00 0.00 61.98 60.96 3flk s VAL 187 Cb -0.12 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.27 3flk s VAL 187 CO -0.05 0.54 0.04 -0.89 0.00 0.00 0.00 175.10 174.74 3flk s THR 188 N 0.57 4.38 -0.25 3.92 2.01 0.75 -1.60 115.64 125.41 3flk s THR 188 Ca -0.11 -0.17 -0.11 0.00 0.31 0.00 0.00 61.69 61.61 3flk s THR 188 Cb -0.16 -2.98 -0.05 0.00 0.01 0.00 0.00 72.50 69.32 3flk s THR 188 CO 0.04 0.43 0.17 -0.55 -0.69 0.00 0.00 174.62 174.01 3flk s SER 189 N 0.75 6.05 -0.01 3.53 0.15 0.10 -0.43 113.70 123.85 3flk s SER 189 Ca 0.02 0.06 -0.30 0.00 0.70 0.00 0.00 55.95 56.43 3flk s SER 189 Cb -0.14 -2.10 -0.04 0.00 -1.71 0.00 0.00 66.02 62.04 3flk s SER 189 CO 0.02 0.03 1.08 0.00 1.20 0.00 0.00 173.24 175.56 3flk s ALA 190 N 1.29 3.31 0.26 5.45 0.00 -0.04 -1.64 121.76 130.38 3flk s ALA 190 Ca 0.07 0.62 0.02 0.00 0.00 0.00 0.00 51.96 52.67 3flk s ALA 190 Cb -0.14 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.53 3flk s ALA 190 CO 0.06 -0.41 0.20 -0.08 0.00 0.00 0.00 175.76 175.53 3flk s THR 191 N 1.33 0.00 -0.43 0.00 -1.32 -0.26 -4.68 115.64 110.28 3flk s THR 191 Ca 0.54 -1.98 0.08 0.00 -1.21 0.00 0.00 61.69 59.12 3flk s THR 191 Cb -0.24 -2.50 0.34 0.00 -1.51 0.00 0.00 72.50 68.60 3flk s THR 191 CO 0.26 0.00 1.10 1.17 -2.21 0.00 0.00 174.62 174.95 3flk n LYS 192 N -0.42 1.05 0.00 7.08 3.00 -1.26 0.41 118.16 128.02 3flk n LYS 192 Ca 0.04 -2.16 0.02 0.00 -0.00 0.00 0.00 58.31 56.21 3flk n LYS 192 Cb 0.64 -0.95 0.14 0.00 0.00 0.00 0.00 35.03 34.87 3flk n LYS 192 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 3flk n SER 193 N 0.15 0.00 -0.11 3.14 3.41 -1.26 -3.16 113.62 115.80 3flk n SER 193 Ca 0.07 -1.85 -0.20 0.00 -0.26 0.00 0.00 58.87 56.64 3flk n SER 193 Cb 0.73 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.60 3flk n SER 193 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3flk n ASN 194 N -0.57 1.90 -1.37 4.04 0.23 -1.26 -4.64 115.26 113.58 3flk n ASN 194 Ca 0.03 0.42 0.00 0.00 -0.53 0.00 0.00 54.58 54.50 3flk n ASN 194 Cb 0.02 -0.87 0.00 0.00 -2.08 0.00 0.00 39.78 36.85 3flk n ASN 194 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3flk n GLY 195 N 1.41 1.97 0.00 4.83 0.00 -1.19 -5.05 105.19 107.16 3flk n GLY 195 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.69 3flk n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3flk n ALA 197 N 1.21 0.00 -0.00 4.61 0.00 -1.26 -5.13 120.51 119.94 3flk n ALA 197 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 3flk n ALA 197 Cb 0.41 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.85 3flk n ALA 197 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3flk n ILE 198 N 0.00 0.68 0.50 0.00 5.41 -1.26 -4.64 119.36 120.05 3flk n ILE 198 Ca 0.00 0.12 0.00 0.00 1.00 0.00 0.00 62.75 63.87 3flk n ILE 198 Cb 0.00 -1.62 0.00 0.00 -0.71 0.00 0.00 39.64 37.31 3flk n ILE 198 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3flk n SER 199 N -3.39 0.05 0.00 4.38 3.41 -1.26 -3.04 113.62 113.77 3flk n SER 199 Ca -0.06 -0.55 0.00 0.00 -0.26 0.00 0.00 58.87 58.00 3flk n SER 199 Cb 0.36 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.28 3flk n SER 199 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 3flk n PRO 201 N -0.33 0.00 -0.08 4.33 -0.02 -1.26 -1.54 135.00 136.10 3flk n PRO 201 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.36 3flk n PRO 201 Cb 0.01 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.44 3flk n PRO 201 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 3flk h TYR 202 N 0.00 0.48 -0.54 6.00 3.20 -1.89 -1.11 116.97 123.11 3flk h TYR 202 Ca 0.00 -0.11 0.07 0.00 3.14 0.00 0.00 58.73 61.83 3flk h TYR 202 Cb 0.00 -0.12 -0.06 0.00 1.54 0.00 0.00 36.73 38.10 3flk h TYR 202 CO 0.00 0.68 0.23 2.35 -1.64 0.00 0.00 178.16 179.78 3flk h TRP 203 N 0.15 0.42 -0.63 -3.82 2.91 -1.57 -0.98 115.95 112.43 3flk h TRP 203 Ca 0.05 0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.12 3flk h TRP 203 Cb 0.52 -0.11 -0.04 0.00 -0.51 0.00 0.00 29.16 29.03 3flk h TRP 203 CO 0.05 0.16 0.39 -0.44 -1.03 0.00 0.00 178.44 177.58 3flk h ASP 204 N 0.44 0.64 -0.47 2.65 5.19 -1.82 -0.62 116.42 122.43 3flk h ASP 204 Ca 0.26 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.66 3flk h ASP 204 Cb 0.24 -0.14 -0.02 0.00 0.18 0.00 0.00 39.33 39.59 3flk h ASP 204 CO -0.22 0.45 0.30 0.50 -3.12 0.00 0.00 179.24 177.15 3flk h LYS 205 N 0.77 0.64 -0.10 3.56 3.64 -0.58 -0.85 116.57 123.66 3flk h LYS 205 Ca 0.25 -0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.46 3flk h LYS 205 Cb 0.01 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 3flk h LYS 205 CO -0.10 0.45 -0.46 0.00 -2.27 0.00 0.00 179.45 177.07 3flk h ARG 206 N 0.64 0.24 -0.14 1.90 2.47 -1.00 -1.97 114.38 116.51 3flk h ARG 206 Ca 0.17 -0.13 -0.01 0.00 -1.26 0.00 0.00 59.98 58.75 3flk h ARG 206 Cb -0.03 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.28 3flk h ARG 206 CO -0.03 0.66 0.04 1.15 0.56 0.00 0.00 179.97 182.34 3flk h THR 207 N 0.20 1.19 -0.68 2.04 2.02 -0.75 -2.94 112.91 113.98 3flk h THR 207 Ca 0.01 -0.61 0.07 0.00 0.77 0.00 0.00 66.41 66.65 3flk h THR 207 Cb 0.89 1.33 -0.06 0.00 -1.74 0.00 0.00 68.15 68.57 3flk h THR 207 CO 0.07 0.18 0.37 -0.33 0.37 0.00 0.00 175.52 176.18 3flk h GLU 208 N 0.04 0.64 -0.13 6.66 5.08 -1.09 0.80 114.58 126.58 3flk h GLU 208 Ca 0.05 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3flk h GLU 208 Cb 0.25 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3flk h GLU 208 CO 0.00 0.42 0.00 0.00 -1.00 0.00 0.00 179.01 178.43 3flk n ALA 209 N -2.37 1.20 0.00 3.43 0.00 -0.75 -2.88 120.51 119.14 3flk n ALA 209 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3flk n ALA 209 Cb 0.20 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.65 3flk n ALA 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3flk n ALA 211 N 0.42 0.00 0.21 0.00 0.00 0.27 -4.23 120.51 117.18 3flk n ALA 211 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 3flk n ALA 211 Cb 0.03 0.00 0.48 0.00 0.00 0.00 0.00 19.45 19.96 3flk n ALA 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3flk h ALA 212 N 0.00 1.35 -0.03 0.00 0.00 -1.79 -2.63 119.26 116.15 3flk h ALA 212 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3flk h ALA 212 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3flk h ALA 212 CO 0.00 0.34 0.00 0.72 0.00 0.00 0.00 179.25 180.31 3flk n HIS 213 N -3.92 0.04 -3.54 0.00 8.25 -1.26 -4.44 115.22 110.35 3flk n HIS 213 Ca -0.02 -0.02 -0.27 0.00 -0.26 0.00 0.00 57.72 57.15 3flk n HIS 213 Cb 0.35 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.36 3flk n HIS 213 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3flk n TYR 214 N -0.56 1.05 0.14 4.41 4.01 -0.99 -4.97 117.16 120.25 3flk n TYR 214 Ca 0.17 -3.77 0.12 0.00 -0.16 0.00 0.00 57.90 54.26 3flk n TYR 214 Cb 0.14 -0.20 0.64 0.00 -0.31 0.00 0.00 39.34 39.61 3flk n TYR 214 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3flk h PRO 215 N 5.18 0.05 0.00 -0.72 0.13 -1.78 -2.46 132.00 132.39 3flk h PRO 215 Ca 0.20 -0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.27 3flk h PRO 215 Cb 0.83 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.94 3flk h PRO 215 CO 0.55 0.03 -0.24 0.45 -0.23 0.00 0.00 178.00 178.56 3flk h HIS 216 N 0.05 0.00 -3.43 1.56 3.86 -1.94 -3.45 115.15 111.80 3flk h HIS 216 Ca 0.11 0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 58.72 3flk h HIS 216 Cb 0.37 0.00 -0.10 0.00 1.06 0.00 0.00 27.41 28.74 3flk h HIS 216 CO -0.00 0.24 0.13 0.08 0.86 0.00 0.00 177.93 179.24 3flk s VAL 217 N -3.16 5.01 0.17 2.45 1.01 -0.93 -4.89 120.40 120.06 3flk s VAL 217 Ca 0.05 1.17 -0.30 0.00 0.00 0.00 0.00 61.98 62.90 3flk s VAL 217 Cb 0.07 -3.94 -0.07 0.00 0.00 0.00 0.00 36.38 32.43 3flk s VAL 217 CO 0.69 0.09 1.01 -0.55 0.00 0.00 0.00 175.10 176.34 3flk s SER 218 N 1.28 7.44 0.01 3.32 0.15 0.03 -4.95 113.70 120.97 3flk s SER 218 Ca 0.28 1.96 -0.01 0.00 0.70 0.00 0.00 55.95 58.88 3flk s SER 218 Cb -0.16 -2.60 -0.01 0.00 -1.71 0.00 0.00 66.02 61.54 3flk s SER 218 CO 0.10 -0.07 0.00 -1.66 1.20 0.00 0.00 173.24 172.81 3flk s TRP 219 N -0.44 0.11 0.04 3.44 1.48 -1.26 -0.72 118.94 121.60 3flk s TRP 219 Ca 0.46 -0.22 -0.02 0.00 -1.06 0.00 0.00 56.10 55.26 3flk s TRP 219 Cb -0.27 -0.08 -0.03 0.00 -1.16 0.00 0.00 33.47 31.93 3flk s TRP 219 CO 0.33 -0.10 -0.00 0.16 -4.06 0.00 0.00 176.95 173.27 3flk s ASP 220 N -0.72 0.38 0.02 -2.66 3.84 -0.63 -4.99 116.67 111.91 3flk s ASP 220 Ca -0.08 -0.81 0.07 0.00 -0.00 0.00 0.00 52.55 51.73 3flk s ASP 220 Cb -0.05 0.19 -0.03 0.00 -1.38 0.00 0.00 42.92 41.65 3flk s ASP 220 CO -0.00 -0.53 -0.20 -1.59 -0.00 0.00 0.00 175.17 172.84 3flk s LYS 221 N -3.22 2.07 -0.02 2.11 -2.85 -1.26 -0.72 119.74 115.85 3flk s LYS 221 Ca 0.00 -0.97 0.01 0.00 -1.00 0.00 0.00 55.97 54.01 3flk s LYS 221 Cb 0.03 -2.15 0.02 0.00 -2.06 0.00 0.00 37.83 33.66 3flk s LYS 221 CO -0.07 0.55 -0.01 -0.65 0.10 0.00 0.00 175.35 175.26 3flk s GLN 222 N -1.21 0.28 0.45 1.78 -0.21 -0.65 -4.94 119.66 115.16 3flk s GLN 222 Ca 0.13 0.01 -0.25 0.00 0.02 0.00 0.00 55.36 55.26 3flk s GLN 222 Cb -0.10 -0.39 -0.08 0.00 1.00 0.00 0.00 33.01 33.44 3flk s GLN 222 CO 0.03 -0.06 1.43 -1.01 -2.12 0.00 0.00 175.29 173.57 3flk s HIS 223 N 0.61 2.43 0.35 0.91 3.76 -1.26 -1.10 115.29 120.99 3flk s HIS 223 Ca -0.06 1.25 0.06 0.00 -0.15 0.00 0.00 55.06 56.16 3flk s HIS 223 Cb -0.09 -3.94 0.72 0.00 1.11 0.00 0.00 32.58 30.39 3flk s HIS 223 CO -0.01 -2.99 1.94 0.97 -0.85 0.00 0.00 174.74 173.80 3flk h ILE 224 N 2.28 1.00 0.04 0.60 6.09 -0.42 -0.88 117.51 126.23 3flk h ILE 224 Ca -0.51 -0.27 -0.00 0.00 -1.37 0.00 0.00 64.86 62.71 3flk h ILE 224 Cb 1.27 0.15 0.00 0.00 0.47 0.00 0.00 36.82 38.71 3flk h ILE 224 CO 0.61 0.14 -0.02 -2.24 -3.07 0.00 0.00 178.15 173.57 3flk h ASP 225 N 0.78 -0.04 0.89 2.19 2.03 -1.90 -1.64 116.42 118.73 3flk h ASP 225 Ca 0.34 -0.12 -0.11 0.00 -0.73 0.00 0.00 57.03 56.41 3flk h ASP 225 Cb 0.31 0.01 -0.02 0.00 -0.83 0.00 0.00 39.33 38.81 3flk h ASP 225 CO -0.12 0.09 -0.52 -0.29 -1.03 0.00 0.00 179.24 177.37 3flk h ILE 226 N -0.18 1.12 -0.17 4.15 6.09 -1.87 -2.74 117.51 123.91 3flk h ILE 226 Ca -0.01 -1.98 -0.00 0.00 -1.37 0.00 0.00 64.86 61.50 3flk h ILE 226 Cb 0.16 2.15 -0.01 0.00 0.47 0.00 0.00 36.82 39.60 3flk h ILE 226 CO 0.01 0.51 0.09 0.25 -3.07 0.00 0.00 178.15 175.95 3flk h LEU 227 N 0.00 0.22 -0.72 2.19 5.85 -1.03 -0.19 115.31 121.63 3flk h LEU 227 Ca -0.01 -0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.70 3flk h LEU 227 Cb 1.11 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 42.03 3flk h LEU 227 CO 0.07 0.24 0.40 0.00 -0.34 0.00 0.00 178.44 178.81 3flk h ALA 229 N 1.38 1.23 0.00 0.00 0.00 -1.17 -2.79 119.26 117.91 3flk h ALA 229 Ca 0.33 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.10 3flk h ALA 229 Cb 0.23 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3flk h ALA 229 CO -0.20 0.48 -0.44 0.00 0.00 0.00 0.00 179.25 179.09 3flk h ARG 230 N 1.18 0.00 -0.68 0.00 3.08 -0.32 -1.22 114.38 116.43 3flk h ARG 230 Ca 0.37 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.47 3flk h ARG 230 Cb -0.01 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.00 3flk h ARG 230 CO -0.12 0.44 0.45 0.74 -1.07 0.00 0.00 179.97 180.41 3flk h PHE 231 N 0.00 0.72 0.18 3.04 -1.00 -0.98 0.22 116.94 119.12 3flk h PHE 231 Ca -0.00 0.02 -0.30 0.00 2.81 0.00 0.00 57.97 60.49 3flk h PHE 231 Cb 1.00 -0.24 0.02 0.00 3.61 0.00 0.00 35.95 40.33 3flk h PHE 231 CO 0.00 0.40 -1.44 0.28 -1.61 0.00 0.00 178.31 175.93 3flk h VAL 232 N 0.73 1.14 0.06 -0.55 2.07 -1.45 -3.34 116.25 114.91 3flk h VAL 232 Ca 0.29 -2.53 -0.34 0.00 0.82 0.00 0.00 66.70 64.93 3flk h VAL 232 Cb 0.20 2.90 -0.04 0.00 -1.52 0.00 0.00 31.29 32.83 3flk h VAL 232 CO -0.09 0.78 -1.95 0.18 0.02 0.00 0.00 177.57 176.51 3flk n LEU 233 N -3.80 1.82 -3.06 2.57 4.77 -0.50 -4.71 117.00 114.10 3flk n LEU 233 Ca -0.21 0.25 -0.19 0.00 -0.03 0.00 0.00 56.01 55.83 3flk n LEU 233 Cb 1.00 -0.51 -0.03 0.00 -2.33 0.00 0.00 43.42 41.55 3flk n LEU 233 CO 0.51 0.66 -0.15 0.00 -1.33 0.00 0.00 177.39 177.08 3flk n GLN 234 N -3.25 0.75 0.17 3.23 10.64 0.75 -4.97 117.38 124.69 3flk n GLN 234 Ca -0.27 -2.80 0.13 0.00 -1.83 0.00 0.00 57.00 52.23 3flk n GLN 234 Cb 1.05 -1.30 0.57 0.00 -0.86 0.00 0.00 30.24 29.70 3flk n GLN 234 CO 0.00 0.00 0.00 -1.00 -1.83 0.00 0.00 177.06 174.23 3flk h PRO 235 N 3.93 0.00 0.00 2.61 0.13 -1.63 -3.01 132.00 134.04 3flk h PRO 235 Ca 0.01 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.13 3flk h PRO 235 Cb 0.93 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.06 3flk h PRO 235 CO 0.42 0.00 -0.04 1.05 -0.23 0.00 0.00 178.00 179.20 3flk h GLU 236 N 0.00 0.00 0.00 0.86 9.09 -1.76 -2.93 114.58 119.85 3flk h GLU 236 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3flk h GLU 236 Cb 0.34 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.44 3flk h GLU 236 CO 0.00 0.04 0.00 0.00 0.05 0.00 0.00 179.01 179.10 3flk h ARG 237 N 0.00 0.00 -5.81 1.06 2.47 -1.82 -3.46 114.38 106.83 3flk h ARG 237 Ca -0.00 0.00 -0.66 0.00 -1.26 0.00 0.00 59.98 58.06 3flk h ARG 237 Cb 0.27 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 28.51 3flk h ARG 237 CO 0.01 0.00 -0.52 -0.06 0.56 0.00 0.00 179.97 179.96 3flk s PHE 238 N -3.32 3.48 0.15 3.04 0.08 -1.11 -4.99 117.98 115.32 3flk s PHE 238 Ca 0.05 0.37 0.00 0.00 0.12 0.00 0.00 56.93 57.47 3flk s PHE 238 Cb 0.10 -1.84 0.00 0.00 -0.57 0.00 0.00 43.02 40.70 3flk s PHE 238 CO 0.44 0.64 0.00 -3.47 -0.10 0.00 0.00 175.22 172.73 3flk n ASP 239 N 1.43 0.35 -4.23 1.36 2.03 -1.26 -4.53 116.55 111.70 3flk n ASP 239 Ca -0.15 0.25 -0.34 0.00 0.52 0.00 0.00 54.79 55.07 3flk n ASP 239 Cb 0.53 0.04 -0.15 0.00 -0.72 0.00 0.00 41.12 40.82 3flk n ASP 239 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3flk s VAL 240 N -1.76 2.67 -0.24 5.18 1.01 -1.03 -0.47 120.40 125.76 3flk s VAL 240 Ca 0.00 -0.75 -0.01 0.00 0.00 0.00 0.00 61.98 61.22 3flk s VAL 240 Cb 0.00 -2.15 0.02 0.00 0.00 0.00 0.00 36.38 34.25 3flk s VAL 240 CO 0.00 0.50 -0.07 -0.69 0.00 0.00 0.00 175.10 174.84 3flk s VAL 241 N 1.12 2.82 -0.13 2.92 1.01 0.23 -0.18 120.40 128.19 3flk s VAL 241 Ca 0.01 -1.00 -0.05 0.00 0.00 0.00 0.00 61.98 60.94 3flk s VAL 241 Cb -0.14 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 3flk s VAL 241 CO -0.05 0.24 0.05 0.54 0.00 0.00 0.00 175.10 175.88 3flk s VAL 242 N 1.33 4.74 0.11 2.92 0.11 0.43 0.34 120.40 130.38 3flk s VAL 242 Ca 0.01 -0.07 -0.16 0.00 -2.93 0.00 0.00 61.98 58.82 3flk s VAL 242 Cb -0.16 -3.06 0.03 0.00 -1.53 0.00 0.00 36.38 31.66 3flk s VAL 242 CO -0.05 0.56 0.40 0.00 -3.33 0.00 0.00 175.10 172.68 3flk s ALA 244 N -0.44 -0.94 1.15 1.54 0.00 -0.61 -0.86 121.76 121.60 3flk s ALA 244 Ca 0.09 0.02 -0.17 0.00 0.00 0.00 0.00 51.96 51.90 3flk s ALA 244 Cb -0.12 0.62 0.26 0.00 0.00 0.00 0.00 23.12 23.89 3flk s ALA 244 CO 0.02 -0.61 1.08 -1.54 0.00 0.00 0.00 175.76 174.72 3flk s SER 245 N -2.65 1.33 0.16 0.00 1.04 -1.26 -1.38 113.70 110.92 3flk s SER 245 Ca 0.01 0.91 -0.21 0.00 0.48 0.00 0.00 55.95 57.14 3flk s SER 245 Cb 0.01 -1.36 0.05 0.00 0.10 0.00 0.00 66.02 64.83 3flk s SER 245 CO -0.10 -3.90 1.63 -1.13 0.98 0.00 0.00 173.24 170.72 3flk h ASN 246 N -2.43 -0.71 -0.03 7.02 -0.73 -1.77 0.95 115.58 117.89 3flk h ASN 246 Ca -0.50 0.14 -0.02 0.00 1.87 0.00 0.00 56.30 57.79 3flk h ASN 246 Cb 1.32 0.35 -0.00 0.00 0.27 0.00 0.00 38.32 40.26 3flk h ASN 246 CO 0.44 -0.25 -0.04 0.25 -0.37 0.00 0.00 177.43 177.45 3flk h LEU 247 N -0.20 0.10 -0.78 0.34 5.85 -1.90 -2.51 115.31 116.22 3flk h LEU 247 Ca 0.15 -0.52 -0.06 0.00 0.84 0.00 0.00 57.88 58.30 3flk h LEU 247 Cb 0.43 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 3flk h LEU 247 CO -0.41 0.60 0.20 -0.26 -0.34 0.00 0.00 178.44 178.23 3flk h PHE 248 N -0.40 1.16 -0.67 1.25 0.04 -1.89 -1.73 116.94 114.70 3flk h PHE 248 Ca 0.00 -0.12 -0.06 0.00 2.80 0.00 0.00 57.97 60.59 3flk h PHE 248 Cb 0.57 -0.33 -0.03 0.00 2.20 0.00 0.00 35.95 38.36 3flk h PHE 248 CO 0.10 0.93 0.18 0.78 -0.60 0.00 0.00 178.31 179.70 3flk h GLY 249 N 1.09 1.13 0.72 -1.45 0.00 -0.90 -1.56 103.07 102.10 3flk h GLY 249 Ca 0.23 -0.68 0.02 0.00 0.00 0.00 0.00 47.33 46.90 3flk h GLY 249 CO -0.00 0.63 -0.11 -1.80 0.00 0.00 0.00 176.54 175.26 3flk h ASP 250 N 1.01 -0.31 -0.01 0.19 1.82 -0.99 -2.24 116.42 115.89 3flk h ASP 250 Ca 0.22 0.05 0.00 0.00 -0.39 0.00 0.00 57.03 56.90 3flk h ASP 250 Cb 0.33 0.13 -0.00 0.00 0.68 0.00 0.00 39.33 40.47 3flk h ASP 250 CO -0.00 -0.15 0.01 0.40 -1.61 0.00 0.00 179.24 177.88 3flk h ILE 251 N -0.18 1.01 0.00 2.25 2.04 -1.16 -3.05 117.51 118.43 3flk h ILE 251 Ca 0.04 -0.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 3flk h ILE 251 Cb 0.23 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 3flk h ILE 251 CO -0.11 0.01 -0.20 -0.07 0.00 0.00 0.00 178.15 177.78 3flk h LEU 252 N 0.01 0.00 -0.34 1.44 3.38 -1.25 -1.95 115.31 116.58 3flk h LEU 252 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3flk h LEU 252 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3flk h LEU 252 CO -0.00 0.20 -0.10 -1.54 0.09 0.00 0.00 178.44 177.09 3flk n SER 253 N -3.93 0.64 -0.09 -0.43 3.41 -0.85 -0.95 113.62 111.42 3flk n SER 253 Ca -0.02 -0.79 -0.19 0.00 -0.26 0.00 0.00 58.87 57.61 3flk n SER 253 Cb 0.29 -0.03 -0.13 0.00 -0.26 0.00 0.00 64.21 64.08 3flk n SER 253 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3flk n ASP 254 N -0.76 2.03 -0.03 4.04 9.92 -0.94 -4.50 116.55 126.30 3flk n ASP 254 Ca 0.16 -0.03 -0.12 0.00 -0.53 0.00 0.00 54.79 54.27 3flk n ASP 254 Cb 0.28 -0.55 -0.06 0.00 -0.64 0.00 0.00 41.12 40.15 3flk n ASP 254 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 3flk h LEU 255 N 0.02 0.18 0.13 0.64 5.85 -1.33 -2.49 115.31 118.30 3flk h LEU 255 Ca -0.53 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 57.97 3flk h LEU 255 Cb 1.94 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 42.88 3flk h LEU 255 CO -0.04 0.36 -0.47 1.23 -0.34 0.00 0.00 178.44 179.18 3flk h GLY 256 N -0.02 -1.18 0.71 3.75 0.00 -1.31 -1.31 103.07 103.71 3flk h GLY 256 Ca 0.04 0.63 0.12 0.00 0.00 0.00 0.00 47.33 48.12 3flk h GLY 256 CO 0.00 -0.29 0.53 -2.55 0.00 0.00 0.00 176.54 174.22 3flk h PRO 257 N -0.68 0.61 -0.81 4.80 0.11 -1.79 -1.98 132.00 132.26 3flk h PRO 257 Ca -0.01 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.06 3flk h PRO 257 Cb 0.68 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 31.61 3flk h PRO 257 CO -0.25 0.40 0.49 0.00 -0.21 0.00 0.00 178.00 178.44 3flk h ALA 258 N 1.62 1.03 -0.39 -0.75 0.00 -0.95 -0.87 119.26 118.94 3flk h ALA 258 Ca 0.39 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 3flk h ALA 258 Cb 0.64 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3flk h ALA 258 CO -0.15 0.49 0.18 0.00 0.00 0.00 0.00 179.25 179.77 3flk n ALA 260 N -2.47 2.61 0.00 0.00 0.00 -0.65 -3.00 120.51 117.00 3flk n ALA 260 Ca 0.03 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3flk n ALA 260 Cb 0.12 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.11 3flk n ALA 260 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3flk n GLY 261 N 1.17 1.44 3.59 0.00 0.00 -0.43 -4.65 105.19 106.31 3flk n GLY 261 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 3flk n GLY 261 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3flk s THR 262 N -1.37 0.00 -1.41 2.61 -1.32 -0.86 -4.86 115.64 108.44 3flk s THR 262 Ca 0.00 0.00 0.28 0.00 -1.21 0.00 0.00 61.69 60.76 3flk s THR 262 Cb 0.00 -1.00 0.35 0.00 -1.51 0.00 0.00 72.50 70.34 3flk s THR 262 CO 0.00 0.00 1.83 2.30 -2.21 0.00 0.00 174.62 176.54 3flk n ILE 263 N 1.00 0.00 0.67 5.08 -0.00 -1.26 -4.11 119.36 120.73 3flk n ILE 263 Ca -0.11 -0.03 0.09 0.00 -0.00 0.00 0.00 62.75 62.70 3flk n ILE 263 Cb 0.57 -0.16 0.40 0.00 -0.00 0.00 0.00 39.64 40.46 3flk n ILE 263 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 3flk n GLY 264 N 1.35 -1.11 0.00 3.28 0.00 -1.26 -3.23 105.19 104.23 3flk n GLY 264 Ca 0.12 -0.07 0.05 0.00 0.00 0.00 0.00 46.02 46.12 3flk n GLY 264 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3flk n ILE 265 N -1.47 0.00 -2.35 -0.61 -5.35 -1.26 -1.96 119.36 106.36 3flk n ILE 265 Ca 0.05 -0.25 -0.43 0.00 -0.27 0.00 0.00 62.75 61.85 3flk n ILE 265 Cb 0.21 0.82 -0.02 0.00 -1.74 0.00 0.00 39.64 38.90 3flk n ILE 265 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3flk s ALA 266 N -2.21 3.33 0.54 -1.28 0.00 -1.20 -3.67 121.76 117.28 3flk s ALA 266 Ca 0.02 0.17 -0.00 0.00 0.00 0.00 0.00 51.96 52.14 3flk s ALA 266 Cb 0.08 -3.80 0.02 0.00 0.00 0.00 0.00 23.12 19.43 3flk s ALA 266 CO 0.45 -1.84 0.78 -1.25 0.00 0.00 0.00 175.76 173.90 3flk s PRO 267 N 4.31 2.67 -0.09 0.00 0.04 -1.26 -1.12 135.00 139.55 3flk s PRO 267 Ca 0.60 -0.60 -0.08 0.00 0.04 0.00 0.00 61.00 60.96 3flk s PRO 267 Cb -0.18 -2.46 0.03 0.00 0.04 0.00 0.00 34.50 31.92 3flk s PRO 267 CO 0.25 -0.65 0.23 -1.54 0.04 0.00 0.00 177.00 175.34 3flk s SER 268 N -4.37 -0.25 -0.26 6.66 1.04 0.33 -4.21 113.70 112.64 3flk s SER 268 Ca 0.55 0.48 -0.03 0.00 0.48 0.00 0.00 55.95 57.43 3flk s SER 268 Cb -0.10 0.46 0.02 0.00 0.10 0.00 0.00 66.02 66.50 3flk s SER 268 CO 0.39 -0.09 -0.03 0.00 0.98 0.00 0.00 173.24 174.49 3flk s ALA 269 N 0.30 2.79 -0.78 5.32 0.00 -0.22 -2.01 121.76 127.16 3flk s ALA 269 Ca -0.01 -1.47 -0.17 0.00 0.00 0.00 0.00 51.96 50.30 3flk s ALA 269 Cb -0.03 -1.80 0.15 0.00 0.00 0.00 0.00 23.12 21.44 3flk s ALA 269 CO -0.01 -0.85 0.86 -0.80 0.00 0.00 0.00 175.76 174.96 3flk s ASN 270 N 1.36 6.52 -0.16 0.00 0.01 0.12 -0.87 114.94 121.93 3flk s ASN 270 Ca 0.01 -2.04 -0.10 0.00 -0.71 0.00 0.00 52.86 50.01 3flk s ASN 270 Cb -0.17 -2.30 -0.05 0.00 0.41 0.00 0.00 41.25 39.14 3flk s ASN 270 CO -0.03 -0.92 0.18 -0.76 -1.51 0.00 0.00 177.10 174.06 3flk s LEU 271 N 1.87 4.29 -0.75 0.60 1.43 0.57 -1.05 118.68 125.63 3flk s LEU 271 Ca 0.20 0.40 -0.13 0.00 -1.03 0.00 0.00 54.13 53.57 3flk s LEU 271 Cb -0.13 -2.16 0.20 0.00 0.03 0.00 0.00 46.19 44.12 3flk s LEU 271 CO -0.04 0.25 0.68 0.21 0.23 0.00 0.00 176.35 177.68 3flk s ASN 272 N -0.14 6.48 0.52 2.29 3.84 -1.26 -2.46 114.94 124.21 3flk s ASN 272 Ca 0.13 -2.54 0.17 0.00 0.21 0.00 0.00 52.86 50.83 3flk s ASN 272 Cb -0.12 -2.16 1.31 0.00 -0.55 0.00 0.00 41.25 39.73 3flk s ASN 272 CO 0.02 -0.60 2.15 -0.65 -2.79 0.00 0.00 177.10 175.23 3flk h PRO 273 N 7.89 0.00 0.00 0.43 0.11 -1.94 -0.05 132.00 138.44 3flk h PRO 273 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 3flk h PRO 273 Cb 1.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3flk h PRO 273 CO 0.80 0.01 0.00 0.39 -0.21 0.00 0.00 178.00 178.99 3flk n GLU 274 N -4.45 0.11 -3.19 1.05 4.71 -1.26 -4.91 120.64 112.70 3flk n GLU 274 Ca -0.03 0.23 -0.22 0.00 -0.01 0.00 0.00 57.16 57.12 3flk n GLU 274 Cb 0.10 -1.66 0.05 0.00 -1.01 0.00 0.00 31.44 28.92 3flk n GLU 274 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 3flk n ARG 275 N -1.85 -5.81 0.10 3.49 1.74 -0.03 -4.90 116.66 109.40 3flk n ARG 275 Ca 0.04 0.87 -0.01 0.00 -0.77 0.00 0.00 57.85 57.99 3flk n ARG 275 Cb 0.28 -5.75 -0.03 0.00 -1.02 0.00 0.00 32.46 25.94 3flk n ARG 275 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 3flk h ASN 276 N -1.79 0.00 -4.23 0.55 2.35 -1.91 -3.46 115.58 107.08 3flk h ASN 276 Ca -0.53 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 54.92 3flk h ASN 276 Cb 1.36 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 39.58 3flk h ASN 276 CO 0.56 0.66 -0.71 -0.36 -1.65 0.00 0.00 177.43 175.92 3flk s PHE 277 N -2.88 1.12 0.36 1.19 0.08 -1.26 -5.13 117.98 111.45 3flk s PHE 277 Ca 0.02 -0.78 -0.28 0.00 0.12 0.00 0.00 56.93 56.01 3flk s PHE 277 Cb 0.08 -0.59 -0.11 0.00 -0.57 0.00 0.00 43.02 41.83 3flk s PHE 277 CO 0.78 0.00 1.41 -1.25 -0.10 0.00 0.00 175.22 176.05 3flk s PRO 278 N -3.56 4.22 0.60 0.24 0.04 -1.26 -4.75 135.00 130.54 3flk s PRO 278 Ca 0.13 2.41 -0.07 0.00 0.04 0.00 0.00 61.00 63.51 3flk s PRO 278 Cb 0.02 -3.01 -0.00 0.00 0.04 0.00 0.00 34.50 31.55 3flk s PRO 278 CO -0.01 -0.38 0.94 -1.12 0.04 0.00 0.00 177.00 176.47 3flk s SER 279 N -0.29 5.70 -0.06 6.66 0.01 -1.26 -4.79 113.70 119.67 3flk s SER 279 Ca 0.51 0.89 0.05 0.00 1.31 0.00 0.00 55.95 58.71 3flk s SER 279 Cb -0.44 -1.89 -0.00 0.00 0.21 0.00 0.00 66.02 63.90 3flk s SER 279 CO 0.59 -1.04 -0.20 -0.22 0.41 0.00 0.00 173.24 172.77 3flk s LEU 280 N -5.05 1.96 -0.10 2.44 0.20 -0.22 -0.82 118.68 117.09 3flk s LEU 280 Ca 0.54 -0.42 0.02 0.00 0.69 0.00 0.00 54.13 54.96 3flk s LEU 280 Cb -0.11 -1.14 0.01 0.00 -0.43 0.00 0.00 46.19 44.52 3flk s LEU 280 CO 0.47 0.17 -0.18 -0.36 -0.29 0.00 0.00 176.35 176.17 3flk s PHE 281 N 0.07 2.12 0.09 5.38 0.08 0.81 0.15 117.98 126.69 3flk s PHE 281 Ca -0.07 -0.95 -0.20 0.00 0.12 0.00 0.00 56.93 55.84 3flk s PHE 281 Cb -0.13 -1.49 0.05 0.00 -0.57 0.00 0.00 43.02 40.88 3flk s PHE 281 CO 0.04 -0.45 0.48 -1.83 -0.10 0.00 0.00 175.22 173.36 3flk s GLU 282 N 0.76 1.07 0.75 0.44 -1.05 -0.85 -0.60 118.70 119.21 3flk s GLU 282 Ca -0.11 -0.46 -0.12 0.00 -0.15 0.00 0.00 54.97 54.13 3flk s GLU 282 Cb -0.16 0.48 0.05 0.00 -0.44 0.00 0.00 34.13 34.06 3flk s GLU 282 CO 0.02 -0.41 1.12 -1.25 0.95 0.00 0.00 175.26 175.69 3flk s PRO 283 N -3.14 2.22 0.20 -4.83 0.04 -1.26 -0.52 135.00 127.72 3flk s PRO 283 Ca -0.01 1.38 -0.08 0.00 0.04 0.00 0.00 61.00 62.32 3flk s PRO 283 Cb 0.00 -1.88 0.14 0.00 0.04 0.00 0.00 34.50 32.80 3flk s PRO 283 CO -0.07 -1.70 1.76 0.28 0.04 0.00 0.00 177.00 177.31 3flk h VAL 284 N -0.76 1.26 -4.23 -0.36 2.07 -1.36 -3.43 116.25 109.44 3flk h VAL 284 Ca -0.45 -0.85 -0.51 0.00 0.82 0.00 0.00 66.70 65.71 3flk h VAL 284 Cb 1.25 0.40 0.18 0.00 -1.52 0.00 0.00 31.29 31.59 3flk h VAL 284 CO 0.50 0.34 0.24 -1.38 0.02 0.00 0.00 177.57 177.30 3flk s HIS 285 N -5.49 1.92 0.00 1.57 -3.43 -1.26 -5.07 115.29 103.53 3flk s HIS 285 Ca -0.12 1.67 0.00 0.00 -0.80 0.00 0.00 55.06 55.81 3flk s HIS 285 Cb 0.15 -3.24 0.00 0.00 -1.43 0.00 0.00 32.58 28.06 3flk s HIS 285 CO 0.84 -2.54 0.00 0.41 -2.00 0.00 0.00 174.74 171.45 3flk n GLY 286 N -0.25 1.27 0.01 -1.38 0.00 -1.26 -4.87 105.19 98.71 3flk n GLY 286 Ca 0.10 -1.80 0.14 0.00 0.00 0.00 0.00 46.02 44.47 3flk n GLY 286 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3flk n SER 287 N 0.00 0.07 -3.88 1.61 3.41 -1.26 -4.72 113.62 108.85 3flk n SER 287 Ca 0.00 0.20 -0.33 0.00 -0.26 0.00 0.00 58.87 58.48 3flk n SER 287 Cb 0.00 -0.35 0.01 0.00 -0.26 0.00 0.00 64.21 63.60 3flk n SER 287 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3flk n ALA 288 N -1.41 -2.62 0.25 7.33 0.00 -1.26 -1.08 120.51 121.72 3flk n ALA 288 Ca 0.09 -0.40 0.10 0.00 0.00 0.00 0.00 53.44 53.24 3flk n ALA 288 Cb 0.31 -1.41 0.69 0.00 0.00 0.00 0.00 19.45 19.04 3flk n ALA 288 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3flk h PRO 289 N -1.14 0.00 0.00 0.00 0.11 -1.93 -2.28 132.00 126.76 3flk h PRO 289 Ca -0.64 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.47 3flk h PRO 289 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 3flk h PRO 289 CO 0.41 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 174.73 3flk n ASP 290 N -4.40 0.00 0.00 -2.05 2.03 -1.26 -3.23 116.55 107.64 3flk n ASP 290 Ca -0.02 0.16 0.00 0.00 0.52 0.00 0.00 54.79 55.45 3flk n ASP 290 Cb 0.13 -0.38 0.00 0.00 -0.72 0.00 0.00 41.12 40.15 3flk n ASP 290 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 3flk n ILE 291 N -1.38 0.00 -1.79 5.18 -5.35 -0.93 -5.05 119.36 110.04 3flk n ILE 291 Ca 0.10 -0.44 -0.42 0.00 -0.27 0.00 0.00 62.75 61.72 3flk n ILE 291 Cb 0.26 1.07 -0.02 0.00 -1.74 0.00 0.00 39.64 39.20 3flk n ILE 291 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 3flk s PHE 292 N -0.36 2.86 0.00 4.28 5.36 -0.90 -2.82 117.98 126.39 3flk s PHE 292 Ca 0.00 0.60 0.00 0.00 -0.96 0.00 0.00 56.93 56.57 3flk s PHE 292 Cb 0.00 -4.07 0.00 0.00 -0.34 0.00 0.00 43.02 38.61 3flk s PHE 292 CO 0.00 -3.82 0.00 0.41 -1.46 0.00 0.00 175.22 170.35 3flk n GLY 293 N 3.06 3.09 1.22 13.12 0.00 -1.26 -4.91 105.19 119.51 3flk n GLY 293 Ca 0.12 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.25 3flk n GLY 293 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3flk n LYS 294 N -1.35 2.62 -4.22 1.61 0.00 -1.13 -4.99 118.16 110.70 3flk n LYS 294 Ca 0.00 -2.46 -0.36 0.00 -0.00 0.00 0.00 58.31 55.49 3flk n LYS 294 Cb 0.00 -1.52 -0.06 0.00 -0.00 0.00 0.00 35.03 33.45 3flk n LYS 294 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3flk n ASN 295 N 1.51 -0.83 -0.00 -5.58 3.02 -1.26 -4.84 115.26 107.28 3flk n ASN 295 Ca 0.21 -1.28 0.00 0.00 -0.03 0.00 0.00 54.58 53.49 3flk n ASN 295 Cb 0.60 -1.68 0.00 0.00 -0.61 0.00 0.00 39.78 38.09 3flk n ASN 295 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 3flk n ILE 296 N -4.75 0.00 -1.69 2.41 -5.35 -1.26 -1.50 119.36 107.22 3flk n ILE 296 Ca -0.25 -0.50 -0.44 0.00 -0.27 0.00 0.00 62.75 61.28 3flk n ILE 296 Cb 0.65 1.00 -0.03 0.00 -1.74 0.00 0.00 39.64 39.52 3flk n ILE 296 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3flk n ALA 297 N -0.07 1.83 -2.10 -1.28 0.00 -1.26 -4.52 120.51 113.10 3flk n ALA 297 Ca 0.00 0.42 -0.42 0.00 0.00 0.00 0.00 53.44 53.43 3flk n ALA 297 Cb 0.00 -2.39 -0.03 0.00 0.00 0.00 0.00 19.45 17.03 3flk n ALA 297 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3flk s ASN 298 N 0.78 6.67 0.00 0.00 3.84 -1.26 -4.22 114.94 120.75 3flk s ASN 298 Ca 0.74 2.03 0.28 0.00 0.21 0.00 0.00 52.86 56.12 3flk s ASN 298 Cb -0.61 -2.53 1.09 0.00 -0.55 0.00 0.00 41.25 38.65 3flk s ASN 298 CO 0.40 -0.95 1.77 -0.81 -2.79 0.00 0.00 177.10 174.72 3flk n PRO 299 N 7.12 1.33 -0.32 0.43 -0.04 -1.26 -4.40 135.00 137.86 3flk n PRO 299 Ca 0.17 -0.70 -0.04 0.00 -0.04 0.00 0.00 63.50 62.89 3flk n PRO 299 Cb 0.44 -1.49 0.08 0.00 -0.04 0.00 0.00 33.50 32.49 3flk n PRO 299 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 3flk h ILE 300 N 1.70 1.26 0.00 0.52 2.04 -1.92 -1.36 117.51 119.75 3flk h ILE 300 Ca 0.00 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.16 3flk h ILE 300 Cb 0.44 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.64 3flk h ILE 300 CO 0.00 0.31 0.00 0.00 0.00 0.00 0.00 178.15 178.46 3flk n ALA 301 N -2.41 0.86 0.00 1.87 0.00 -0.83 -0.19 120.51 119.81 3flk n ALA 301 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3flk n ALA 301 Cb 0.13 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.73 3flk n ALA 301 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3flk n ILE 303 N 0.40 0.00 -0.30 0.00 5.41 -0.51 -1.51 119.36 122.84 3flk n ILE 303 Ca 0.00 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 63.73 3flk n ILE 303 Cb 0.00 0.00 0.10 0.00 -0.71 0.00 0.00 39.64 39.03 3flk n ILE 303 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 176.55 176.30 3flk h TRP 304 N 0.00 1.00 -0.92 1.39 2.91 -0.84 -0.84 115.95 118.64 3flk h TRP 304 Ca 0.00 0.03 0.13 0.00 1.13 0.00 0.00 58.89 60.17 3flk h TRP 304 Cb 0.00 -0.33 -0.07 0.00 -0.51 0.00 0.00 29.16 28.25 3flk h TRP 304 CO 0.00 0.58 0.59 0.77 -1.03 0.00 0.00 178.44 179.35 3flk h SER 305 N 1.04 0.77 -0.57 2.65 0.02 -1.49 -1.02 113.55 114.95 3flk h SER 305 Ca 0.33 0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 61.26 3flk h SER 305 Cb -0.00 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 3flk h SER 305 CO -0.11 0.41 0.12 1.23 -1.14 0.00 0.00 176.83 177.34 3flk h GLY 306 N 0.82 0.99 1.01 -3.77 0.00 -1.46 -2.92 103.07 97.73 3flk h GLY 306 Ca 0.46 -0.63 0.00 0.00 0.00 0.00 0.00 47.33 47.16 3flk h GLY 306 CO -0.22 0.59 0.47 0.00 0.00 0.00 0.00 176.54 177.38 3flk h ALA 307 N 1.01 0.93 0.00 3.60 0.00 -0.45 -1.92 119.26 122.43 3flk h ALA 307 Ca 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3flk h ALA 307 Cb 0.37 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3flk h ALA 307 CO 0.00 0.36 0.00 1.28 0.00 0.00 0.00 179.25 180.90 3flk n LEU 308 N -4.56 0.18 0.00 0.00 4.77 -0.48 -1.63 117.00 115.29 3flk n LEU 308 Ca 0.07 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 3flk n LEU 308 Cb 0.03 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3flk n LEU 308 CO 0.36 0.03 0.00 0.18 -1.33 0.00 0.00 177.39 176.63 3flk n LEU 310 N 0.89 0.00 -0.23 2.23 4.77 -0.72 -1.37 117.00 122.57 3flk n LEU 310 Ca 0.00 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.94 3flk n LEU 310 Cb 0.03 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.18 3flk n LEU 310 CO 0.00 0.00 1.12 -0.08 -1.33 0.00 0.00 177.39 177.10 3flk h GLU 311 N 0.00 0.78 -0.24 3.23 4.81 -1.51 -0.21 114.58 121.44 3flk h GLU 311 Ca 0.00 -0.05 -0.18 0.00 -0.13 0.00 0.00 59.36 59.01 3flk h GLU 311 Cb 0.00 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.21 3flk h GLU 311 CO 0.00 0.51 -0.54 0.35 -0.73 0.00 0.00 179.01 178.60 3flk h PHE 312 N 0.80 1.00 -0.02 0.92 3.57 -1.49 -3.23 116.94 118.49 3flk h PHE 312 Ca 0.26 -0.38 -0.12 0.00 3.53 0.00 0.00 57.97 61.26 3flk h PHE 312 Cb 0.00 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.55 3flk h PHE 312 CO -0.05 1.19 -0.55 -0.07 -2.23 0.00 0.00 178.31 176.60 3flk h LEU 313 N 0.53 0.05 -0.51 0.59 3.38 -1.80 -3.32 115.31 114.24 3flk h LEU 313 Ca -0.00 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3flk h LEU 313 Cb 1.15 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 3flk h LEU 313 CO 0.12 0.59 0.27 1.23 0.09 0.00 0.00 178.44 180.74 3flk h GLY 314 N 1.59 0.76 0.00 0.83 0.00 -1.05 -3.46 103.07 101.75 3flk h GLY 314 Ca -0.00 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.97 3flk h GLY 314 CO 0.07 0.34 0.00 -1.06 0.00 0.00 0.00 176.54 175.90 3flk n GLN 315 N -4.63 0.00 0.00 4.80 6.02 -1.25 -1.50 117.38 120.82 3flk n GLN 315 Ca 0.02 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.13 3flk n GLN 315 Cb 0.09 0.00 0.12 0.00 1.02 0.00 0.00 30.24 31.48 3flk n GLN 315 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3flk n GLY 316 N 0.00 -0.52 3.63 1.08 0.00 -1.26 -4.92 105.19 103.20 3flk n GLY 316 Ca 0.00 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 3flk n GLY 316 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3flk s ASP 317 N -2.65 6.76 0.44 1.61 -1.08 -0.56 -4.94 116.67 116.24 3flk s ASP 317 Ca 0.17 0.91 0.21 0.00 -0.52 0.00 0.00 52.55 53.32 3flk s ASP 317 Cb 0.18 -2.42 1.01 0.00 -1.46 0.00 0.00 42.92 40.24 3flk s ASP 317 CO 0.63 -0.52 1.90 1.05 0.52 0.00 0.00 175.17 178.75 3flk h GLU 318 N 7.81 0.00 -0.79 4.34 9.09 -1.91 -3.03 114.58 130.08 3flk h GLU 318 Ca -0.24 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.17 3flk h GLU 318 Cb 1.10 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 28.16 3flk h GLU 318 CO 0.86 0.26 0.50 0.00 0.05 0.00 0.00 179.01 180.68 3flk h ARG 319 N 0.00 1.06 -0.19 1.06 3.08 -1.92 -1.67 114.38 115.81 3flk h ARG 319 Ca -0.00 -0.08 -0.15 0.00 0.07 0.00 0.00 59.98 59.81 3flk h ARG 319 Cb 0.59 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 3flk h ARG 319 CO 0.03 0.73 -0.52 1.88 -1.07 0.00 0.00 179.97 181.03 3flk h TYR 320 N 1.08 0.65 -0.53 3.04 0.05 -1.86 -1.49 116.97 117.91 3flk h TYR 320 Ca 0.29 -0.22 -0.09 0.00 0.05 0.00 0.00 58.73 58.75 3flk h TYR 320 Cb -0.07 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 37.52 3flk h TYR 320 CO -0.01 0.93 -0.04 0.37 -1.05 0.00 0.00 178.16 178.37 3flk h GLN 321 N 0.41 0.95 -0.30 4.88 5.75 -1.52 -1.50 115.11 123.79 3flk h GLN 321 Ca 0.01 -0.32 -0.10 0.00 -0.15 0.00 0.00 58.65 58.09 3flk h GLN 321 Cb 1.04 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.50 3flk h GLN 321 CO 0.10 0.99 -0.25 0.00 -2.65 0.00 0.00 178.83 177.01 3flk h ARG 322 N 0.83 0.58 -0.40 1.69 3.08 -1.23 -1.33 114.38 117.59 3flk h ARG 322 Ca 0.14 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 3flk h ARG 322 Cb 0.58 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.58 3flk h ARG 322 CO 0.03 0.78 0.17 0.00 -1.07 0.00 0.00 179.97 179.88 3flk h ALA 323 N 1.22 0.52 -0.04 0.04 0.00 -1.10 0.31 119.26 120.20 3flk h ALA 323 Ca 0.07 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.88 3flk h ALA 323 Cb 0.70 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 3flk h ALA 323 CO 0.05 0.11 -0.13 1.25 0.00 0.00 0.00 179.25 180.53 3flk h HIS 324 N 0.50 -0.33 -0.87 0.00 -0.00 -1.10 -3.05 115.15 110.29 3flk h HIS 324 Ca 0.13 0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.50 3flk h HIS 324 Cb 0.17 0.16 -0.04 0.00 -0.00 0.00 0.00 27.41 27.70 3flk h HIS 324 CO -0.00 -0.20 0.48 -0.44 -0.00 0.00 0.00 177.93 177.77 3flk h ASP 325 N -0.20 1.08 0.00 3.26 5.19 -1.05 -1.93 116.42 122.77 3flk h ASP 325 Ca 0.06 -0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 3flk h ASP 325 Cb 0.28 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 39.52 3flk h ASP 325 CO -0.16 0.87 0.00 0.47 -3.12 0.00 0.00 179.24 177.30 3flk n ASP 326 N -4.34 1.21 0.00 6.45 8.00 0.08 -1.20 116.55 126.76 3flk n ASP 326 Ca 0.09 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.76 3flk n ASP 326 Cb 0.10 -0.21 0.00 0.00 -0.02 0.00 0.00 41.12 40.99 3flk n ASP 326 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3flk n LEU 328 N 0.77 0.00 -0.10 0.64 7.99 -0.73 -0.81 117.00 124.77 3flk n LEU 328 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 56.01 55.93 3flk n LEU 328 Cb 0.20 0.00 0.01 0.00 -0.11 0.00 0.00 43.42 43.52 3flk n LEU 328 CO 0.00 0.00 0.95 -1.13 -1.51 0.00 0.00 177.39 175.70 3flk h ASN 329 N 0.00 0.18 -0.60 -1.43 -0.73 -1.43 -0.48 115.58 111.10 3flk h ASN 329 Ca 0.00 0.03 -0.03 0.00 1.87 0.00 0.00 56.30 58.16 3flk h ASN 329 Cb 0.00 -0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.56 3flk h ASN 329 CO 0.00 0.14 0.25 0.00 -0.37 0.00 0.00 177.43 177.45 3flk h ALA 330 N 1.19 0.78 -0.09 1.57 0.00 -1.24 -1.59 119.26 119.88 3flk h ALA 330 Ca 0.14 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3flk h ALA 330 Cb 0.09 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3flk h ALA 330 CO -0.13 0.39 0.05 0.82 0.00 0.00 0.00 179.25 180.38 3flk h ILE 331 N 0.83 1.01 -0.49 0.00 2.04 -1.77 -2.17 117.51 116.95 3flk h ILE 331 Ca 0.20 -0.04 0.06 0.00 1.00 0.00 0.00 64.86 66.08 3flk h ILE 331 Cb 0.19 0.89 -0.05 0.00 -0.74 0.00 0.00 36.82 37.11 3flk h ILE 331 CO -0.02 0.02 0.19 -0.33 0.00 0.00 0.00 178.15 178.01 3flk h GLU 332 N 0.11 0.37 -0.40 2.37 5.08 -0.88 -2.11 114.58 119.12 3flk h GLU 332 Ca 0.03 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 3flk h GLU 332 Cb -0.01 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 3flk h GLU 332 CO -0.01 0.24 0.09 0.00 -1.00 0.00 0.00 179.01 178.33 3flk h ARG 333 N 0.38 0.65 -0.70 2.33 3.08 -1.18 -1.39 114.38 117.56 3flk h ARG 333 Ca 0.23 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 3flk h ARG 333 Cb 0.23 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 3flk h ARG 333 CO -0.22 0.68 0.32 0.28 -1.07 0.00 0.00 179.97 179.95 3flk h VAL 334 N 0.51 1.23 -0.32 2.04 2.07 -1.25 -0.17 116.25 120.37 3flk h VAL 334 Ca 0.13 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 3flk h VAL 334 Cb 0.32 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 3flk h VAL 334 CO 0.00 0.28 0.14 0.40 0.02 0.00 0.00 177.57 178.41 3flk h ILE 335 N 0.97 1.17 -0.82 4.57 2.04 -1.27 -1.31 117.51 122.86 3flk h ILE 335 Ca 0.24 -0.51 0.03 0.00 1.00 0.00 0.00 64.86 65.61 3flk h ILE 335 Cb 0.14 0.92 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 3flk h ILE 335 CO -0.03 0.18 0.54 0.00 0.00 0.00 0.00 178.15 178.85 3flk h ALA 336 N 0.99 1.47 0.00 1.87 0.00 -0.94 -2.30 119.26 120.35 3flk h ALA 336 Ca 0.11 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3flk h ALA 336 Cb 0.15 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 3flk h ALA 336 CO -0.01 0.46 -0.11 -0.44 0.00 0.00 0.00 179.25 179.15 3flk h ASP 337 N 1.05 0.00 0.00 0.00 3.32 -0.77 -3.47 116.42 116.55 3flk h ASP 337 Ca 0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.37 3flk h ASP 337 Cb -0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.53 3flk h ASP 337 CO -0.09 0.11 0.00 0.61 -1.72 0.00 0.00 179.24 178.16 3flk n GLY 338 N 0.13 0.53 2.60 2.75 0.00 -0.83 -4.97 105.19 105.41 3flk n GLY 338 Ca 0.00 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 3flk n GLY 338 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3flk n SER 339 N 0.80 5.66 -4.16 1.61 7.64 -0.56 -4.67 113.62 119.94 3flk n SER 339 Ca 0.00 -2.80 -0.17 0.00 1.01 0.00 0.00 58.87 56.91 3flk n SER 339 Cb 0.00 -1.60 -0.10 0.00 -1.01 0.00 0.00 64.21 61.50 3flk n SER 339 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 3flk s VAL 340 N 2.43 0.39 0.75 0.44 -7.23 -1.26 -4.73 120.40 111.18 3flk s VAL 340 Ca 0.54 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.60 3flk s VAL 340 Cb 0.15 -2.57 0.05 0.00 0.56 0.00 0.00 36.38 34.58 3flk s VAL 340 CO -0.07 0.00 1.11 0.42 -0.31 0.00 0.00 175.10 176.25 3flk s THR 341 N -3.75 2.59 0.56 5.32 -4.23 -1.26 -1.92 115.64 112.95 3flk s THR 341 Ca 0.37 0.09 0.26 0.00 -1.18 0.00 0.00 61.69 61.23 3flk s THR 341 Cb 0.06 -3.17 0.36 0.00 1.34 0.00 0.00 72.50 71.10 3flk s THR 341 CO 0.15 -0.21 2.06 -0.65 -0.54 0.00 0.00 174.62 175.42 3flk h PRO 342 N -0.81 0.00 -1.72 3.99 0.11 -1.73 -2.17 132.00 129.67 3flk h PRO 342 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3flk h PRO 342 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3flk h PRO 342 CO 0.64 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.03 3flk n ASP 343 N -4.07 1.15 0.00 -2.05 5.68 -1.26 -4.29 116.55 111.71 3flk n ASP 343 Ca 0.04 -0.82 0.00 0.00 -0.50 0.00 0.00 54.79 53.51 3flk n ASP 343 Cb 0.42 -0.21 0.00 0.00 -1.14 0.00 0.00 41.12 40.19 3flk n ASP 343 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3flk n GLY 345 N 1.01 0.24 2.57 6.12 0.00 -1.17 -4.78 105.19 109.18 3flk n GLY 345 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 3flk n GLY 345 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3flk n GLY 346 N -0.19 1.36 0.00 -0.02 0.00 -0.83 -5.05 105.19 100.45 3flk n GLY 346 Ca 0.00 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.91 3flk n GLY 346 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3flk n THR 347 N -2.08 0.17 -2.62 2.61 -2.24 -1.13 -3.00 114.28 105.98 3flk n THR 347 Ca 0.11 -0.51 -0.33 0.00 -2.27 0.00 0.00 64.05 61.05 3flk n THR 347 Cb 0.39 1.04 -0.05 0.00 -2.10 0.00 0.00 70.33 69.61 3flk n THR 347 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3flk s LEU 348 N -0.17 3.84 0.74 3.22 1.43 -0.81 -4.91 118.68 122.02 3flk s LEU 348 Ca 0.00 1.76 -0.10 0.00 -1.03 0.00 0.00 54.13 54.75 3flk s LEU 348 Cb 0.00 -4.54 0.05 0.00 0.03 0.00 0.00 46.19 41.73 3flk s LEU 348 CO 0.00 -0.58 1.10 -0.94 0.23 0.00 0.00 176.35 176.17 3flk s SER 349 N -2.28 4.93 0.19 2.29 1.04 -1.26 -4.14 113.70 114.47 3flk s SER 349 Ca 0.63 0.83 -0.17 0.00 0.48 0.00 0.00 55.95 57.73 3flk s SER 349 Cb -0.12 -1.48 0.16 0.00 0.10 0.00 0.00 66.02 64.68 3flk s SER 349 CO 0.19 -1.61 1.63 0.74 0.98 0.00 0.00 173.24 175.16 3flk h THR 350 N -0.79 0.37 -0.30 2.02 2.02 -1.44 -1.65 112.91 113.14 3flk h THR 350 Ca -0.45 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 66.62 3flk h THR 350 Cb 1.30 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 3flk h THR 350 CO 0.64 0.00 -0.24 1.56 0.37 0.00 0.00 175.52 177.85 3flk h GLN 351 N -0.07 0.59 -0.39 6.66 7.50 -1.90 -2.11 115.11 125.39 3flk h GLN 351 Ca 0.25 -0.23 -0.11 0.00 0.50 0.00 0.00 58.65 59.07 3flk h GLN 351 Cb 0.45 -0.03 -0.02 0.00 0.05 0.00 0.00 27.48 27.93 3flk h GLN 351 CO -0.58 0.78 -0.18 1.96 -1.50 0.00 0.00 178.83 179.31 3flk h GLN 352 N 0.52 0.75 -0.26 1.46 4.20 -1.80 -0.97 115.11 119.01 3flk h GLN 352 Ca 0.08 -0.28 -0.07 0.00 0.06 0.00 0.00 58.65 58.44 3flk h GLN 352 Cb 0.69 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 3flk h GLN 352 CO 0.05 0.88 -0.10 0.28 -0.67 0.00 0.00 178.83 179.27 3flk h VAL 353 N 0.66 1.29 -0.47 -0.54 2.07 -1.09 -0.72 116.25 117.46 3flk h VAL 353 Ca 0.10 -1.15 0.08 0.00 0.82 0.00 0.00 66.70 66.55 3flk h VAL 353 Cb 0.67 1.50 -0.07 0.00 -1.52 0.00 0.00 31.29 31.88 3flk h VAL 353 CO 0.05 0.36 0.08 1.23 0.02 0.00 0.00 177.57 179.31 3flk h GLY 354 N 0.26 0.55 1.01 2.17 0.00 -1.28 -1.01 103.07 104.78 3flk h GLY 354 Ca 0.06 -0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.35 3flk h GLY 354 CO 0.03 -0.07 0.34 0.00 0.00 0.00 0.00 176.54 176.84 3flk h ALA 355 N 1.37 0.93 -0.64 3.60 0.00 -1.09 -1.51 119.26 121.91 3flk h ALA 355 Ca 0.23 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3flk h ALA 355 Cb 0.31 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3flk h ALA 355 CO -0.31 0.50 0.12 0.00 0.00 0.00 0.00 179.25 179.55 3flk h ALA 356 N 1.16 0.85 -0.23 0.00 0.00 -0.64 -0.27 119.26 120.13 3flk h ALA 356 Ca 0.25 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 3flk h ALA 356 Cb 0.13 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3flk h ALA 356 CO -0.03 0.60 -0.22 0.82 0.00 0.00 0.00 179.25 180.42 3flk h ILE 357 N 0.97 1.32 -0.45 0.00 2.04 -1.11 -1.49 117.51 118.79 3flk h ILE 357 Ca 0.20 -1.37 0.01 0.00 1.00 0.00 0.00 64.86 64.70 3flk h ILE 357 Cb 0.41 1.68 -0.03 0.00 -0.74 0.00 0.00 36.82 38.14 3flk h ILE 357 CO 0.01 0.43 0.28 -1.28 0.00 0.00 0.00 178.15 177.58 3flk h SER 358 N 0.26 0.46 -0.36 1.72 0.87 -1.19 -0.66 113.55 114.65 3flk h SER 358 Ca 0.04 -0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.54 3flk h SER 358 Cb 0.76 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 3flk h SER 358 CO 0.05 0.33 -0.01 -0.78 -0.53 0.00 0.00 176.83 175.90 3flk h ASP 359 N 0.56 0.63 -0.69 6.23 3.58 -1.05 -2.18 116.42 123.50 3flk h ASP 359 Ca 0.17 -0.31 0.02 0.00 0.42 0.00 0.00 57.03 57.33 3flk h ASP 359 Cb -0.02 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 40.82 3flk h ASP 359 CO -0.06 0.79 0.44 0.74 -2.88 0.00 0.00 179.24 178.27 3flk h THR 360 N 0.45 1.12 -0.34 2.25 2.02 -1.12 -2.14 112.91 115.15 3flk h THR 360 Ca 0.10 -0.30 -0.00 0.00 0.77 0.00 0.00 66.41 66.98 3flk h THR 360 Cb 0.47 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 3flk h THR 360 CO 0.02 0.16 0.21 0.25 0.37 0.00 0.00 175.52 176.53 3flk h LEU 361 N 0.88 0.41 -1.85 2.58 6.46 -1.01 -2.46 115.31 120.32 3flk h LEU 361 Ca 0.27 -0.05 -0.03 0.00 -0.12 0.00 0.00 57.88 57.95 3flk h LEU 361 Cb -0.02 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 39.80 3flk h LEU 361 CO -0.09 0.34 -0.13 0.00 -0.62 0.00 0.00 178.44 177.94 3flk h ALA 362 N 1.09 1.57 -0.01 1.25 0.00 -1.13 -2.62 119.26 119.41 3flk h ALA 362 Ca 0.12 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3flk h ALA 362 Cb 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3flk h ALA 362 CO -0.02 0.16 -0.12 0.54 0.00 0.00 0.00 179.25 179.81 3flk n ARG 363 N -4.08 1.33 0.00 0.00 1.74 -0.83 -5.11 116.66 109.71 3flk n ARG 363 Ca -0.02 -0.81 0.08 0.00 -0.77 0.00 0.00 57.85 56.33 3flk n ARG 363 Cb 0.21 -1.48 0.45 0.00 -1.02 0.00 0.00 32.46 30.62 3flk n ARG 363 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39